data_1x60_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 1x60 _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 ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.516 -0.349 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.1 m-85 -101.79 105.91 16.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.069 0.461 . . . . 0.0 110.186 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -125.21 151.91 45.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.332 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.515 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -103.85 142.62 17.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.184 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -136.33 131.94 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.863 0.363 . . . . 0.0 111.342 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.468 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.36 -5.46 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.69 173.54 28.3 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 119.236 -1.459 . . . . 0.0 114.43 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.41 142.74 23.38 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -147.75 150.62 34.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.038 0.447 . . . . 0.0 111.405 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -60.54 -15.07 23.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.415 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.4 t -106.54 129.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 121.112 0.482 . . . . 0.0 111.785 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.456 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.2 ttpt -71.88 -39.17 69.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.512 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.72 -32.0 66.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.132 0.491 . . . . 0.0 109.827 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -77.51 -34.43 54.04 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.259 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -19.49 60.98 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.839 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.67 -38.34 21.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -38.03 88.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.459 ' CG ' HG13 ' A' ' 14' ' ' ILE . 50.5 tp -65.95 -50.06 65.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.217 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.54 -24.32 60.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.485 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.85 -41.5 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.612 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -58.68 -47.38 84.68 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.513 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.448 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -61.51 -40.29 94.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.522 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.71 -37.31 65.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.304 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.32 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.36 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -62.5 -28.48 69.87 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.66 32.92 3.0 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.54 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.487 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.3 m-85 -100.35 155.88 17.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -85.02 94.51 8.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.8 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.6 p -80.17 156.0 27.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.175 0.512 . . . . 0.0 111.017 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.66 137.71 7.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.913 -178.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 47.5 t -114.98 113.86 44.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.028 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.006 0.431 . . . . 0.0 110.499 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.456 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.9 m-85 . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.88 148.24 29.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.129 0.49 . . . . 0.0 111.815 -179.243 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.4 HG11 HD12 ' A' ' 14' ' ' ILE . 90.2 t -120.77 101.62 10.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.787 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HG2' ' N ' ' A' ' 50' ' ' ILE . 1.9 tt0 -107.5 142.19 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.864 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.505 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.13 123.07 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.518 0.675 . . . . 0.0 111.449 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.427 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.11 105.57 0.22 Allowed Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.865 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.1 124.87 40.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.647 0.261 . . . . 0.0 110.505 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.69 172.99 11.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.136 0.493 . . . . 0.0 111.499 -179.344 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -83.04 -15.92 49.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.997 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 128.52 56.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.898 0.38 . . . . 0.0 111.028 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -56.32 -34.92 67.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.212 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.48 -30.88 32.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.442 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 63.9 m-80 -70.8 -50.24 37.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.681 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.405 ' HB3' ' CG1' ' A' ' 75' ' ' VAL . . . -59.75 -40.2 87.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.926 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -60.47 -51.47 69.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -59.02 -35.98 74.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.486 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.63 -52.04 29.52 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.846 0.831 . . . . 0.0 110.131 179.518 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.515 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -53.69 -59.05 5.11 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.993 -177.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.6 -36.75 56.9 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.522 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.5 ttt180 -64.33 -38.72 92.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.766 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.462 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.94 -40.88 95.71 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.543 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.9 mttm -61.86 -46.88 87.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.678 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.52 -25.69 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.817 178.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.458 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.08 -22.54 52.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.4 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.1 23.93 5.34 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.583 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.41 148.46 52.66 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.6 t70 -92.33 74.32 5.3 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.579 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -84.33 142.9 29.85 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-O 121.234 0.54 . . . . 0.0 111.845 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.419 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.51 152.74 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.016 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.405 ' CG1' ' HB3' ' A' ' 59' ' ' ALA . 90.8 t -104.91 134.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.902 0.382 . . . . 0.0 110.848 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.5 tt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.286 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.516 -0.341 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.9 m-85 -101.7 105.74 16.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.127 0.489 . . . . 0.0 110.241 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -125.4 157.3 37.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.1 OUTLIER -110.57 136.24 47.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.356 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.096 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.5 135.32 47.83 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 111.453 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.493 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.32 -6.16 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.47 177.0 29.21 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 119.176 -1.488 . . . . 0.0 114.595 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.65 144.05 24.12 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -147.86 149.65 32.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.382 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -14.31 26.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.47 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 125.28 62.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.041 0.448 . . . . 0.0 111.985 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.2 tmtt? -67.11 -41.01 86.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.492 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.65 66.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.118 0.485 . . . . 0.0 109.906 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -77.93 -35.46 50.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.391 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.98 -19.08 61.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.802 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.53 -37.51 21.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.639 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -37.33 86.14 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.472 ' CG ' HG13 ' A' ' 14' ' ' ILE . 55.5 tp -66.82 -51.01 60.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.999 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 37' ' ' SER . . . -58.15 -24.62 59.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.599 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -72.53 -41.41 65.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.519 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.47 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -58.89 -47.71 84.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.588 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.47 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.87 -40.91 94.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.597 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -55.22 -37.14 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.382 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.91 -50.85 65.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.235 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.7 mmtt -62.45 -28.53 69.87 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.5 31.52 3.21 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.519 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.6 m-85 -100.49 157.26 16.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 0.0 110.794 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -86.81 93.98 9.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.758 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.405 ' HB2' ' CB ' ' A' ' 27' ' ' ALA . 99.2 p -80.29 157.78 26.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.138 0.494 . . . . 0.0 110.918 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -156.27 138.51 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.01 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.1 t -117.41 116.71 52.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.023 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.0 110.692 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 m-85 . . . . . 0 C--O 1.23 0.062 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.585 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -103.88 146.55 28.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.126 0.489 . . . . 0.0 111.722 -179.45 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.442 HG13 HD13 ' A' ' 14' ' ' ILE . 99.4 t -120.99 102.59 12.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.678 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.404 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 36.3 tt0 -111.38 143.76 41.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.274 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.462 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.38 123.82 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.525 0.679 . . . . 0.0 111.454 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.53 109.78 0.29 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.04 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -132.85 122.38 24.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.747 0.308 . . . . 0.0 110.259 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.66 175.44 9.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.071 0.462 . . . . 0.0 111.621 -179.248 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.65 -15.38 39.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.124 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.7 t -112.07 126.94 55.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -55.63 -36.28 66.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.178 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -53.04 -30.05 33.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.904 0.383 . . . . 0.0 110.99 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.451 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 2.7 m-80 -72.84 -49.37 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.741 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.81 -40.96 94.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.003 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -60.38 -49.99 75.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.824 0.345 . . . . 0.0 110.83 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.7 m -58.01 -37.77 74.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.783 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.503 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.8 -50.42 50.42 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.782 0.801 . . . . 0.0 110.177 179.297 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.43 ' CB ' HG13 ' A' ' 12' ' ' VAL . . . -53.2 -60.81 2.82 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.306 -1.315 . . . . 0.0 111.098 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.7 54.28 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.691 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -65.46 -38.02 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.75 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.504 ' CB ' ' HB2' ' A' ' 73' ' ' ALA . . . -65.67 -41.71 92.15 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.714 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.3 mttm -62.04 -46.37 89.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.597 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.28 -25.73 63.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.737 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.467 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.23 -23.83 54.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.8 24.51 4.9 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.546 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.68 149.03 52.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 16.3 t70 -93.26 72.51 4.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.83 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.504 ' HB2' ' CB ' ' A' ' 66' ' ' ALA . . . -87.61 144.75 26.52 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.07 0.462 . . . . 0.0 111.69 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.488 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.0 pp -133.43 157.67 42.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.756 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 84.0 t -109.84 134.68 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.976 0.417 . . . . 0.0 111.029 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 pt . . . . . 0 C--O 1.237 0.41 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.364 -179.951 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mp . . . . . 0 CA--C 1.517 -0.307 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.514 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.2 m-85 -101.92 106.61 17.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.077 0.465 . . . . 0.0 110.05 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.0 mttt -126.45 155.36 42.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.644 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.47 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -108.27 137.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.395 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -129.96 135.82 48.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.572 0.225 . . . . 0.0 110.996 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -109.22 -6.35 11.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -179.124 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.91 174.34 28.49 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 119.047 -1.549 . . . . 0.0 114.781 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.8 143.33 23.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -145.89 149.15 33.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 111.323 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ptpp? -61.7 -13.56 23.93 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.345 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.43 126.44 63.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.061 0.458 . . . . 0.0 111.94 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 5.5 tmtt? -65.87 -42.19 90.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.591 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.54 -33.13 65.8 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.166 0.508 . . . . 0.0 109.895 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -77.16 -36.21 55.37 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.44 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.84 62.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.666 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -35.73 26.88 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 t -64.87 -36.69 85.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.53 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.48 -50.98 48.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.383 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.89 -25.25 56.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.067 0.46 . . . . 0.0 110.592 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -41.37 60.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.761 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.53 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.04 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.845 0.355 . . . . 0.0 110.401 179.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.517 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -59.71 -40.35 87.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.308 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -55.37 -36.45 66.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.88 -51.74 54.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.354 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -62.83 -28.49 70.05 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.5 34.25 2.92 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.502 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.491 ' CD2' HD11 ' A' ' 62' ' ' LEU . 7.6 m-85 -100.84 156.12 17.55 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.126 0.488 . . . . 0.0 110.92 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.33 89.92 7.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.529 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 m -80.33 158.68 26.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 110.526 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -156.87 141.64 8.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.17 -178.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 58.8 t -117.81 116.5 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.005 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.813 0.339 . . . . 0.0 110.658 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.0 m-85 . . . . . 0 N--CA 1.457 -0.08 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -105.06 147.92 27.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.175 0.512 . . . . 0.0 111.744 -179.307 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.423 HG11 HD11 ' A' ' 14' ' ' ILE . 60.5 t -123.08 103.41 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -108.97 143.18 38.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.123 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.473 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.9 pp -135.27 123.89 40.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.519 0.676 . . . . 0.0 111.574 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.73 104.98 0.25 Allowed Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.913 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.01 112.78 14.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.709 0.29 . . . . 0.0 110.339 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.9 171.13 14.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 0.0 111.467 -179.302 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -81.42 -16.44 52.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.007 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.34 131.47 56.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.869 0.366 . . . . 0.0 111.07 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.0 ttpt -58.14 -37.76 75.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.314 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -46.32 -32.54 3.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.094 0.473 . . . . 0.0 110.825 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 10.4 m120 -73.46 -48.83 30.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.28 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.79 -45.53 89.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.163 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.83 -51.1 71.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 71.5 m -59.19 -35.67 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.884 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.491 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.51 -51.92 31.33 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 121.815 0.817 . . . . 0.0 110.129 179.488 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.47 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.6 -59.69 4.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.021 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.06 46.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.387 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt-85 -65.33 -39.9 93.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.88 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.463 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.18 -40.97 97.21 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.703 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 40.6 mttm -62.34 -46.85 86.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.664 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.53 -25.44 64.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.794 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -76.81 -22.49 53.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.368 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.19 23.92 5.61 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.73 149.0 52.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.255 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 31.2 t0 -92.25 74.23 5.37 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.821 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.463 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.67 140.51 30.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.088 0.471 . . . . 0.0 111.842 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pt -132.66 149.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.085 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 91.7 t -102.78 135.8 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 0.0 110.969 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 pt . . . . . 0 C--O 1.236 0.365 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.411 -179.93 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 CA--C 1.516 -0.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.1 m-85 -101.4 106.45 17.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.312 -0.403 . . . . 0.0 109.987 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttm -126.03 155.7 41.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.494 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -107.25 142.77 19.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.211 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.301 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -135.15 132.83 38.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 111.166 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.469 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.09 -5.39 10.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.83 174.1 28.09 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 119.209 -1.472 . . . . 0.0 114.562 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.76 143.85 23.9 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.364 178.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -147.37 151.45 36.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.374 . . . . 0.0 111.286 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -61.14 -15.57 34.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.385 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.4 t -105.8 128.4 60.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 121.032 0.444 . . . . 0.0 112.073 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.4 tmtt? -68.62 -42.59 77.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.481 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.44 -31.29 61.78 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.128 0.489 . . . . 0.0 109.95 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -77.94 -35.2 50.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.464 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.67 -21.19 61.84 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.12 -37.55 23.62 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.441 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -65.15 -36.11 83.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.23 0.538 . . . . 0.0 109.612 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.544 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 31.5 tp -69.07 -48.2 63.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.286 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.16 -25.93 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.064 0.459 . . . . 0.0 110.426 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.2 t -75.1 -40.63 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.544 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.36 -48.25 82.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.921 0.391 . . . . 0.0 110.709 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.516 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.92 -38.38 90.73 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.352 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.76 -36.41 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.323 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -50.99 64.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.513 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 9.6 mmpt? -62.2 -28.01 69.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.37 32.39 3.22 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.421 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.481 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.4 m-85 -99.64 154.76 18.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.01 0.433 . . . . 0.0 110.751 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.39 92.58 7.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.751 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.0 p -79.95 156.06 27.41 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.036 0.446 . . . . 0.0 110.967 -178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.65 141.47 7.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.772 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.591 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.4 t -120.02 119.13 59.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.295 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 110.394 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.47 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.7 m-85 . . . . . 0 C--O 1.228 -0.028 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.591 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.7 149.3 27.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 111.79 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.424 HG21 ' HB3' ' A' ' 26' ' ' LEU . 61.8 t -123.0 104.36 14.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.683 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -109.39 142.75 39.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.117 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.47 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.04 123.66 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-O 121.551 0.691 . . . . 0.0 111.592 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.91 103.91 0.26 Allowed Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.991 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.31 122.69 37.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.85 172.02 13.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.485 . . . . 0.0 111.567 -179.042 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.41 -16.97 47.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.005 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.12 130.8 56.57 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.827 0.346 . . . . 0.0 111.095 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.6 ttpt -57.95 -38.03 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.359 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -46.46 -31.31 2.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.967 0.413 . . . . 0.0 110.775 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.445 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 3.7 m-80 -74.07 -48.69 28.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.379 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.13 -44.63 94.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.155 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -59.07 -52.01 67.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.125 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 14.9 t -59.49 -34.15 72.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.925 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.475 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.03 -51.88 28.58 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.701 0.763 . . . . 0.0 109.932 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.494 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.09 -58.11 8.57 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.878 -177.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.43 -35.96 61.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt180 -64.91 -39.48 93.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.682 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.46 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.91 -40.75 95.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.584 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.577 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 26.3 mttm -61.98 -47.34 85.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.706 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.78 -25.92 64.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.83 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.446 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -76.98 -21.9 54.0 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.388 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.92 23.91 5.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.484 -179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.577 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.01 148.89 52.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 28.1 t70 -92.37 74.58 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.926 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.13 142.0 29.81 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.104 0.478 . . . . 0.0 111.868 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.3 pt -133.77 151.47 33.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.881 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 94.7 t -104.68 134.6 45.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.978 0.418 . . . . 0.0 111.05 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.411 HG21 HD13 ' A' ' 76' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.019 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.0 mt . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.511 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.3 m-85 -102.0 105.64 16.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.011 0.434 . . . . 0.0 110.109 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -124.99 156.36 38.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.437 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -110.5 138.14 39.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.318 179.865 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -132.22 136.48 47.03 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.888 0.375 . . . . 0.0 111.167 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.525 HG13 HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -109.02 -5.39 10.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -179.085 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.38 173.45 28.95 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 118.942 -1.599 . . . . 0.0 114.93 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.416 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.4 142.7 23.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.958 -0.621 . . . . 0.0 109.472 178.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.16 149.23 33.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.878 0.37 . . . . 0.0 111.254 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -60.81 -15.31 28.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.419 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.83 130.27 60.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.637 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -69.43 -40.15 77.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.633 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -35.54 66.11 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.286 0.565 . . . . 0.0 109.619 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -73.99 -34.2 64.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.209 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.45 -19.74 61.51 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -35.49 25.58 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.474 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 t -67.68 -38.92 84.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 0.0 109.724 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.525 HD11 HG13 ' A' ' 14' ' ' ILE . 20.4 tp -65.84 -53.29 41.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.379 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.35 -24.52 63.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -70.85 -42.39 70.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.537 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.502 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.89 -46.25 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.518 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.49 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.668 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.43 -37.18 67.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.149 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.94 -49.99 67.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.268 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.83 -29.04 70.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.423 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.14 32.92 2.89 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.539 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CD2' HD11 ' A' ' 62' ' ' LEU . 6.9 m-85 -101.47 158.36 16.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.053 0.454 . . . . 0.0 110.544 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -87.27 94.86 9.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.634 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.0 p -80.07 157.38 26.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.845 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.91 137.43 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.752 -178.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.7 t -114.22 112.83 41.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.199 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.404 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.165 0 CA-C-O 121.013 0.435 . . . . 0.0 110.921 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.1 m-85 . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.38 148.84 28.57 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.156 0.503 . . . . 0.0 111.993 -179.558 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.432 HG12 ' HG ' ' A' ' 26' ' ' LEU . 42.9 t -121.89 99.01 6.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.307 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -106.42 143.04 35.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.075 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.49 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.75 123.35 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 111.513 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 110.12 0.3 Allowed Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 114.763 -1.108 . . . . 0.0 113.053 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -134.66 112.91 11.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.744 0.307 . . . . 0.0 110.52 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.5 174.53 10.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.039 0.447 . . . . 0.0 111.57 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -84.73 -16.24 42.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.19 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.68 128.3 56.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.9 0.381 . . . . 0.0 111.044 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.511 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.0 -36.86 65.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.228 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -53.01 -30.23 34.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.439 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -72.18 -49.21 37.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.803 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.2 97.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.002 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.61 -50.99 71.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.971 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.2 m -57.12 -37.64 72.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.811 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.506 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.67 -50.1 53.82 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.737 0.78 . . . . 0.0 110.279 179.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.435 ' CB ' HG13 ' A' ' 12' ' ' VAL . . . -53.93 -60.64 3.06 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.166 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.74 59.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -63.88 -40.11 95.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.068 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.476 ' CB ' ' HB3' ' A' ' 73' ' ' ALA . . . -64.43 -40.5 95.87 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.69 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 33.3 mttm -62.03 -46.77 87.74 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -69.32 -26.37 64.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.826 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.445 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.44 54.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.411 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.73 24.19 5.35 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.571 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.74 148.91 52.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.427 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 36.4 t70 -92.63 72.71 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.6 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.482 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -85.16 141.87 29.88 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.149 0.499 . . . . 0.0 111.745 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 7.6 pt -133.11 154.75 40.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.925 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.1 t -108.48 135.82 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.953 0.406 . . . . 0.0 110.881 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 pt . . . . . 0 C--O 1.237 0.425 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.562 -179.725 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt . . . . . 0 CA--C 1.516 -0.341 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.9 m-85 -101.96 105.84 16.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.044 0.449 . . . . 0.0 110.214 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -125.83 153.01 44.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.448 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.509 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.7 136.37 41.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.372 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.358 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.19 135.38 48.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.598 0.237 . . . . 0.0 111.021 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.45 -6.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.789 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.41 172.09 29.4 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 118.834 -1.65 . . . . 0.0 114.885 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.515 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.92 138.1 19.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.849 -0.675 . . . . 0.0 109.486 178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 46' ' ' TYR . 1.6 m-85 -148.72 150.76 33.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 111.079 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -61.21 -12.65 13.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.068 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -109.13 129.9 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 111.907 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.7 -38.35 67.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.592 179.811 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.8 -34.86 63.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.328 0.585 . . . . 0.0 109.634 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -75.4 -31.87 60.56 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.178 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.36 -18.86 60.62 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.93 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -84.71 -38.18 20.04 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.634 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -68.43 -35.73 78.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 109.588 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.466 ' CG ' HG13 ' A' ' 14' ' ' ILE . 56.7 tp -68.14 -51.99 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.119 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.97 -24.43 62.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.408 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.7 m -71.32 -41.27 70.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.5 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -59.64 -46.93 87.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.446 179.568 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.465 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -59.67 -41.45 90.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.556 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -55.63 -36.83 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.233 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.38 -51.19 63.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.393 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.6 mmpt? -62.73 -28.54 70.03 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.91 32.8 2.98 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.513 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.1 m-85 -101.16 157.62 16.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 110.809 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.41 92.23 8.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 77.3 p -80.35 156.66 26.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.142 0.496 . . . . 0.0 111.033 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.89 141.86 5.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.527 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 23.0 t -114.65 111.68 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.175 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.519 ' O ' ' HD3' ' A' ' 47' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 120.918 0.39 . . . . 0.0 110.511 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.6 m-85 . . . . . 0 C--O 1.228 -0.057 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -122.23 158.89 28.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.99 114.08 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.296 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 12' ' ' VAL . 23.2 tt0 -112.45 137.52 50.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.797 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.455 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.54 123.97 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.625 0.726 . . . . 0.0 111.488 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.403 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 78.55 102.35 0.21 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.085 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.11 120.99 31.6 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -141.04 174.32 10.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.153 0.501 . . . . 0.0 111.589 -179.065 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.1 m -84.72 -15.76 44.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.001 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -112.42 128.08 56.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.79 0.329 . . . . 0.0 111.098 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -56.6 -35.18 67.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.27 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -51.86 -31.5 28.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.85 0.357 . . . . 0.0 110.98 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.436 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 9.9 m-80 -71.98 -49.74 34.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.577 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.24 93.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.17 -50.93 71.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.819 0.342 . . . . 0.0 110.793 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.8 m -58.54 -37.12 75.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.824 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.515 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.52 -51.27 44.86 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.752 0.787 . . . . 0.0 110.154 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.509 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.39 -59.97 3.97 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.091 -177.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.31 -36.62 43.51 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -65.69 -39.53 91.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.836 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.471 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.0 -41.88 94.97 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.562 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.0 mmmm -61.79 -46.8 87.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.795 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -69.85 -25.55 63.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.747 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.449 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.38 -22.43 54.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.381 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.94 23.39 5.59 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.446 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.39 147.6 52.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.458 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 33.8 t70 -91.02 73.36 6.41 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.675 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.472 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -85.6 140.55 30.5 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.105 0.478 . . . . 0.0 111.871 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.433 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 pt -132.53 151.15 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.833 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.4 t -103.95 135.72 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.858 0.361 . . . . 0.0 110.982 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.0 pt . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.249 -179.802 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.515 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.5 m-85 -101.94 105.72 16.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.035 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.49 152.98 44.24 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.507 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.35 137.72 35.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.131 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -132.96 134.47 44.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.698 0.285 . . . . 0.0 111.253 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.473 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.86 -4.79 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.96 174.7 29.01 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 119.135 -1.507 . . . . 0.0 114.766 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.401 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.19 141.78 22.63 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -147.87 149.8 32.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.025 0.441 . . . . 0.0 111.351 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -61.58 -13.74 24.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -106.58 126.18 62.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.794 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.12 -40.57 82.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.469 179.58 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.49 -32.27 64.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.263 0.554 . . . . 0.0 109.9 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -77.54 -34.01 54.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.395 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.92 -19.54 60.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.849 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.43 -37.49 21.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.562 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -38.63 88.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.297 0.57 . . . . 0.0 109.63 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.458 ' CG ' HG13 ' A' ' 14' ' ' ILE . 40.5 tp -66.09 -51.48 57.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.188 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.19 -23.93 57.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.543 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.1 m -73.0 -41.32 64.42 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.677 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.459 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.27 -47.16 86.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.604 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.462 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -61.68 -40.61 95.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.578 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -55.14 -37.24 66.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.283 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.76 -49.93 69.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.27 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.51 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -62.39 -28.49 69.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.93 31.43 3.36 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.555 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.0 m-85 -100.1 156.07 17.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.92 0.39 . . . . 0.0 110.799 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.88 93.13 8.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.696 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.0 p -80.28 157.22 26.49 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 121.128 0.489 . . . . 0.0 110.926 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -156.95 139.66 6.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.705 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.58 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.5 t -116.41 115.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.219 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.408 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.812 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 29.6 m-85 . . . . . 0 N--CA 1.462 0.137 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.58 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.55 148.65 28.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.179 0.514 . . . . 0.0 111.84 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.468 HG12 HD12 ' A' ' 14' ' ' ILE . 88.8 t -120.54 100.41 9.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.393 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -108.97 142.39 39.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.319 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.462 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -136.31 122.98 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.538 0.685 . . . . 0.0 111.657 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.16 107.67 0.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.912 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.12 118.59 21.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.651 0.262 . . . . 0.0 110.428 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -138.31 172.79 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 111.48 -179.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -84.15 -15.49 46.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.092 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.29 128.81 56.38 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.0 tmtm? -55.65 -35.58 66.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.275 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -53.17 -29.96 34.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.455 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 26.4 m120 -71.56 -49.85 36.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.721 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.99 -40.87 95.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.061 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.2 -50.96 71.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.741 0.305 . . . . 0.0 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 13.6 m -58.59 -37.46 75.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.5 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.58 -51.03 47.03 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.732 0.777 . . . . 0.0 110.085 179.449 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.507 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.36 -59.99 3.95 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.093 -177.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.84 -36.05 46.77 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.43 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.98 -38.74 89.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.871 178.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.463 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.67 -41.14 96.28 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.662 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -62.27 -46.25 89.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.722 178.776 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -25.54 63.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.694 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.465 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.45 -23.64 53.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.35 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.9 23.38 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.552 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.552 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.67 148.26 52.44 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 45.6 t0 -91.79 74.03 5.75 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.644 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -84.07 142.29 30.52 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.066 0.46 . . . . 0.0 111.956 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.4 pt -133.12 151.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.8 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 96.5 t -105.42 135.41 43.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.393 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 30.1 pt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.221 -179.842 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 CA--C 1.515 -0.397 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -100.93 106.77 18.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.195 0.522 . . . . 0.0 110.17 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -125.85 152.97 44.79 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.403 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.501 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.18 140.57 22.81 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.209 179.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.4 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 42.2 tt0 -132.92 131.81 41.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.717 0.294 . . . . 0.0 111.281 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.479 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.02 -5.57 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -179.284 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.19 172.28 28.31 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 119.104 -1.522 . . . . 0.0 114.634 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.404 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 141.07 22.09 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 114.884 -0.658 . . . . 0.0 109.254 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -146.63 150.28 35.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.913 0.387 . . . . 0.0 111.357 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -13.81 22.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.424 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.45 128.5 60.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.046 0.451 . . . . 0.0 111.989 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 7.2 tmtt? -69.34 -41.13 77.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.487 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.74 -31.06 64.18 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.171 0.51 . . . . 0.0 109.924 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -78.07 -35.1 49.9 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.335 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.32 -22.99 61.85 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.772 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -38.66 26.85 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.531 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -63.67 -37.73 88.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.228 0.537 . . . . 0.0 109.653 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.542 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 27.2 tp -67.31 -46.03 74.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.198 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.39 -26.59 65.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.462 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -41.05 60.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.21 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.542 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.1 -48.07 82.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.695 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.515 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -63.2 -38.2 90.22 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.348 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -54.85 -36.65 65.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.462 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.01 -51.55 56.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.557 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 7.5 mmtm -62.64 -28.13 69.7 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.78 34.47 2.81 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.461 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.491 ' CD2' HD13 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.61 155.41 17.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.975 0.416 . . . . 0.0 110.85 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -83.46 94.34 7.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.824 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 80.1 p -79.96 155.2 27.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.971 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -155.9 139.95 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.699 -178.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.621 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -118.59 116.25 50.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.391 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.405 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 110.724 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.7 m-85 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.621 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.14 150.59 27.02 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 111.541 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.423 HG21 ' HB3' ' A' ' 26' ' ' LEU . 98.3 t -124.36 102.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.633 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HG2' ' N ' ' A' ' 50' ' ' ILE . 2.6 tt0 -106.84 142.86 35.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.047 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.483 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.8 pp -134.62 123.16 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.472 0.654 . . . . 0.0 111.488 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.414 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.22 105.52 0.23 Allowed Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.894 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.88 122.38 32.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.659 0.266 . . . . 0.0 110.397 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -140.74 171.62 13.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.203 0.525 . . . . 0.0 111.454 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -17.25 51.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.866 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.0 t -113.78 130.27 56.47 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.865 0.365 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 13.3 ttpt -57.13 -37.47 72.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.398 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.11 -31.16 3.25 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.966 0.412 . . . . 0.0 110.698 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CD1' ' A' ' 53' ' ' PHE . 19.8 m120 -73.28 -49.99 24.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.235 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.12 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.24 -51.15 71.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.844 0.355 . . . . 0.0 111.009 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 28.3 m -58.84 -35.21 72.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.491 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.33 -51.95 26.33 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.747 0.785 . . . . 0.0 110.187 179.435 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.501 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.99 -57.9 9.29 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.231 -1.35 . . . . 0.0 111.013 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.36 -37.39 62.35 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.429 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -64.47 -38.23 90.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.639 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.452 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.27 -41.15 94.49 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.624 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.8 mttm -62.17 -46.94 86.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.691 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.29 -25.44 64.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.686 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.432 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.16 -22.54 52.37 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.36 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 23.59 5.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.584 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.566 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.36 148.93 52.72 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.5 74.74 5.16 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.807 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.479 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -85.47 141.83 29.65 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.062 0.458 . . . . 0.0 111.95 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.432 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pp -133.27 152.11 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.02 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.9 t -104.78 136.35 38.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.798 0.333 . . . . 0.0 111.085 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.354 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.515 -0.377 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.513 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.6 m-85 -101.43 106.62 17.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.037 0.446 . . . . 0.0 109.997 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.49 155.45 38.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.429 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.526 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -106.78 142.92 18.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.284 179.876 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -133.91 132.74 40.62 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.469 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.07 -5.97 9.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.76 173.79 29.8 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 118.877 -1.63 . . . . 0.0 114.893 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.476 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.01 135.91 17.36 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.962 -0.619 . . . . 0.0 109.71 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 46' ' ' TYR . 2.0 m-85 -145.01 149.37 35.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.8 0.334 . . . . 0.0 111.08 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -60.78 -14.13 19.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.937 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -106.76 127.99 61.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.062 0.458 . . . . 0.0 112.107 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -69.64 -42.27 74.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.579 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.11 -32.52 47.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.177 0.513 . . . . 0.0 109.815 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -76.94 -32.58 57.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.282 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.09 -20.63 60.2 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.891 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -39.13 20.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 110.747 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 t -66.61 -37.13 84.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 0.0 109.659 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.468 ' CG ' HG13 ' A' ' 14' ' ' ILE . 55.8 tp -66.47 -52.1 49.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.182 179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.03 -24.45 58.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.1 t -71.83 -41.74 67.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.556 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -58.88 -47.55 84.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.571 179.599 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.466 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -60.09 -41.41 92.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.648 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.15 -37.02 66.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.234 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.8 -51.12 64.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.341 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.456 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.43 -28.43 69.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.73 31.69 3.11 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.687 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -101.01 158.0 16.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 94.9 9.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.751 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.5 p -80.29 156.83 26.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.227 0.537 . . . . 0.0 110.982 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.97 137.13 5.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.659 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.452 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.3 t -113.98 112.67 41.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.437 ' O ' ' HD3' ' A' ' 47' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 CA-C-O 120.934 0.397 . . . . 0.0 110.614 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.454 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.8 m-85 . . . . . 0 C--O 1.225 -0.2 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.55 156.53 31.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.12 0.486 . . . . 0.0 111.613 -179.342 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.431 HG23 ' HB3' ' A' ' 26' ' ' LEU . 87.9 t -125.43 113.96 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.48 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 3.3 tt0 -111.93 141.32 45.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.475 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.1 123.44 39.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.515 0.674 . . . . 0.0 111.575 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.421 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.29 107.59 0.28 Allowed Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.823 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.37 118.37 22.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.688 0.28 . . . . 0.0 110.553 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.03 174.21 10.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.011 0.434 . . . . 0.0 111.551 -179.402 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.4 p -83.57 -17.04 43.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.093 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -112.55 128.34 56.33 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.85 0.357 . . . . 0.0 111.174 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.513 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.53 -34.74 64.96 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.082 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -52.23 -32.0 34.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.045 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.427 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.9 m120 -70.89 -49.6 44.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.417 ' HB2' ' CG1' ' A' ' 75' ' ' VAL . . . -58.46 -40.54 82.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.012 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -61.66 -49.98 74.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.761 0.315 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 m -59.48 -34.76 72.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.837 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -71.01 -51.52 24.95 Favored 'General case' 0 CA--C 1.503 -0.843 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.5 ' CA ' HG12 ' A' ' 12' ' ' VAL . . . -54.09 -58.25 8.03 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.922 -177.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.67 -37.26 63.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.662 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -64.19 -38.73 92.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.777 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.469 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.79 -41.05 96.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.67 -46.38 89.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -69.79 -26.09 64.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.803 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.446 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.76 -22.85 53.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.404 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.25 23.59 5.42 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.466 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.568 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.72 148.8 52.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.4 t70 -92.34 73.53 5.29 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.675 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -85.43 142.79 28.99 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.116 0.484 . . . . 0.0 111.985 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.9 pt -134.69 162.01 39.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.417 ' CG1' ' HB2' ' A' ' 59' ' ' ALA . 90.0 t -112.29 137.03 46.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.323 -179.897 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -100.83 106.63 18.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.074 0.464 . . . . 0.0 110.069 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -126.31 156.77 39.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.52 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.48 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -107.92 138.99 31.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.316 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.145 179.761 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -131.22 133.75 45.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.717 0.294 . . . . 0.0 111.158 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.468 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.55 -5.64 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.41 175.21 29.08 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.055 -1.545 . . . . 0.0 114.558 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.62 142.54 23.0 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.995 -0.603 . . . . 0.0 109.426 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.404 ' O ' ' HB2' ' A' ' 46' ' ' TYR . 2.8 m-85 -147.53 150.13 33.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.878 0.37 . . . . 0.0 111.346 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.3 pttt -61.72 -13.63 24.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.489 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.27 127.04 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.176 0.512 . . . . 0.0 111.959 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.465 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.09 -42.12 80.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.574 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.23 -31.69 63.77 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.148 0.499 . . . . 0.0 110.02 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -78.22 -34.94 49.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.5 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -19.21 61.04 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.881 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.95 -37.66 20.24 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.496 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -37.73 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.453 ' CG ' HG13 ' A' ' 14' ' ' ILE . 59.6 tp -66.26 -51.63 55.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.127 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.67 -23.87 53.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.534 178.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -41.15 64.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.63 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.08 -46.98 86.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.461 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -62.1 -40.41 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -55.28 -37.11 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.275 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.17 -50.81 66.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.376 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.3 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.07 32.3 3.08 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.537 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.1 m-85 -100.55 155.8 17.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.949 0.404 . . . . 0.0 110.858 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.44 92.41 8.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.697 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 96.4 p -80.12 157.4 26.65 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.175 0.512 . . . . 0.0 110.894 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.85 142.35 6.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.739 -178.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.615 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -121.8 122.41 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.272 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.424 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.465 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.8 m-85 . . . . . 0 C--O 1.231 0.08 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.615 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -103.76 147.03 27.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.917 0.389 . . . . 0.0 111.831 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.448 HG11 HD12 ' A' ' 14' ' ' ILE . 98.7 t -120.96 105.2 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.737 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 15.3 tt0 -111.86 142.04 44.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.416 -179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.461 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.38 123.78 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-O 121.588 0.708 . . . . 0.0 111.561 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.08 106.32 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.872 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.11 117.45 20.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.666 0.269 . . . . 0.0 110.492 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -137.09 170.11 16.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.138 0.494 . . . . 0.0 111.422 -179.334 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -17.08 53.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.47 131.71 56.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.95 0.405 . . . . 0.0 110.947 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.498 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 5.0 ttpt -57.63 -37.96 74.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.376 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -46.04 -32.98 3.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.049 0.452 . . . . 0.0 110.854 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.445 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 13.2 m120 -71.91 -49.2 39.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.411 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.06 -44.57 87.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.084 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.29 -52.31 66.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.76 0.314 . . . . 0.0 111.209 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.04 -34.58 72.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.103 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.489 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.3 -51.9 26.86 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.718 0.77 . . . . 0.0 110.135 179.429 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.48 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.5 -59.13 5.11 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.029 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.72 -37.21 50.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.276 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.0 -38.25 90.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.784 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.446 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.34 -41.91 93.44 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.762 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.9 mttm -62.09 -46.83 87.35 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.638 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.58 -25.29 63.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.811 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.423 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.2 -23.3 51.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.336 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.64 23.36 5.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.412 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.18 149.18 52.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.2 t70 -92.98 74.59 4.78 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.662 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.5 143.41 28.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.135 0.493 . . . . 0.0 111.778 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.5 pt -134.69 151.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.837 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 88.1 t -103.61 135.78 39.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.26 -179.946 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 CA--C 1.516 -0.339 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.516 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.6 m-85 -101.86 106.79 17.81 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.142 0.496 . . . . 0.0 109.874 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -125.05 154.41 41.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.649 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -108.33 137.02 42.06 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.205 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -129.6 135.46 48.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.651 0.263 . . . . 0.0 111.008 -179.391 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -106.23 -5.03 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.64 173.52 28.22 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 118.964 -1.589 . . . . 0.0 114.559 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.87 143.49 23.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.861 -0.669 . . . . 0.0 109.29 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 46' ' ' TYR . 2.9 m-85 -150.03 148.29 28.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.89 0.376 . . . . 0.0 111.393 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -60.8 -13.88 18.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.609 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.08 124.46 61.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.158 0.504 . . . . 0.0 112.116 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -64.93 -44.69 88.68 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.602 179.634 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.65 -31.77 48.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.15 0.5 . . . . 0.0 109.856 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.92 -35.77 50.17 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.593 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.05 -21.51 61.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -37.72 24.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -64.46 -37.18 86.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 109.626 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.543 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 26.8 tp -67.41 -50.8 57.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.331 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.37 -26.39 52.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.083 0.468 . . . . 0.0 110.652 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.34 -41.04 61.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.084 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.543 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.45 -48.92 79.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.962 0.41 . . . . 0.0 110.772 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.531 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -61.14 -39.32 89.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -54.36 -37.15 64.61 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.16 -50.54 64.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.429 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpp? -62.41 -28.37 69.74 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 33.83 2.82 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.501 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 7.2 m-85 -102.05 159.89 14.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.989 0.423 . . . . 0.0 110.626 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -87.56 94.06 9.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.7 p -80.42 157.91 26.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.007 0.432 . . . . 0.0 110.789 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.42 140.12 6.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.007 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.584 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 30.1 t -118.99 118.79 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.002 0.429 . . . . 0.0 110.572 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.2 m-85 . . . . . 0 N--CA 1.46 0.057 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.584 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -102.72 146.5 28.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.229 0.537 . . . . 0.0 111.872 -178.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.467 HG12 HD13 ' A' ' 14' ' ' ILE . 88.4 t -121.79 103.4 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.621 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 9.1 tt0 -110.62 143.64 40.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.634 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.462 HG12 ' CD1' ' A' ' 14' ' ' ILE . 1.8 pp -136.18 123.1 32.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.58 0.705 . . . . 0.0 111.618 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.66 111.78 0.3 Allowed Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.145 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.99 112.72 11.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.248 . . . . 0.0 110.371 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -129.65 173.77 10.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 0.0 111.522 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 m -83.81 -17.66 40.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.967 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.8 131.94 56.04 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.873 0.368 . . . . 0.0 111.078 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpp -58.06 -39.62 78.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.271 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -46.07 -32.52 2.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.96 0.409 . . . . 0.0 110.761 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.422 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 71.0 m-80 -70.98 -49.64 43.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.367 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.49 -41.02 75.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.04 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -61.45 -49.26 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.87 0.367 . . . . 0.0 110.902 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -60.92 -34.93 75.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.855 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.49 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.88 -53.05 16.55 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.877 0.846 . . . . 0.0 110.047 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.71 -58.83 5.99 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.141 -1.391 . . . . 0.0 110.853 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.86 -37.77 53.43 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.413 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.8 ttt180 -64.86 -39.41 93.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.752 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.455 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.03 -41.76 94.96 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.603 179.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 29.9 mttt -62.05 -47.14 86.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.695 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -69.14 -25.59 64.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.723 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.445 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.68 -22.22 54.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.271 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.85 23.74 5.78 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -129.99 148.58 51.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.392 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.478 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.7 t0 -92.06 73.85 5.53 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.926 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.466 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.01 140.57 30.93 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.05 0.452 . . . . 0.0 111.913 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 20.7 pt -133.34 152.11 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.922 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 96.6 t -103.17 138.18 28.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.898 0.38 . . . . 0.0 111.156 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 pt . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.351 -179.894 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 CA--C 1.515 -0.369 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.5 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -101.28 106.38 17.57 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.064 0.459 . . . . 0.0 109.971 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.12 154.3 41.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.458 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.492 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.58 140.5 24.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.19 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -133.37 135.29 44.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 111.243 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.473 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -108.06 -5.43 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.229 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.33 174.23 28.8 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 118.968 -1.587 . . . . 0.0 114.646 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.402 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.21 141.42 22.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.939 -0.631 . . . . 0.0 109.389 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -147.27 149.54 33.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.973 0.416 . . . . 0.0 111.377 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -12.83 16.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.09 125.93 63.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.078 0.466 . . . . 0.0 112.072 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.456 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 10.4 tmtt? -67.02 -42.02 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.414 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.63 -31.32 62.19 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.178 0.514 . . . . 0.0 109.909 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -78.36 -33.96 48.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.473 178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.07 -20.1 60.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -37.54 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -38.41 87.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.326 0.584 . . . . 0.0 109.512 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.461 ' CG ' HG13 ' A' ' 14' ' ' ILE . 41.8 tp -66.26 -51.49 57.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.21 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.0 55.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.579 178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t -72.92 -41.41 64.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.572 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.459 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.23 -47.03 86.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.568 179.834 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.468 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -61.58 -40.66 95.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.507 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -55.11 -37.26 66.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.312 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.28 67.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.171 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.36 -28.49 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.656 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.04 31.5 3.31 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.416 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.1 m-85 -100.18 156.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.984 0.421 . . . . 0.0 110.777 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -85.68 93.33 8.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.728 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.7 p -80.43 157.6 26.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.23 0.538 . . . . 0.0 110.873 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.34 140.1 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.754 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.576 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.15 116.31 51.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.272 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.408 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.179 0 CA-C-O 120.844 0.354 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.456 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.9 m-85 . . . . . 0 CA--C 1.527 0.083 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.576 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.79 148.78 28.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.056 0.455 . . . . 0.0 111.733 -179.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.422 HG13 HD12 ' A' ' 14' ' ' ILE . 90.5 t -121.31 100.9 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.653 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.405 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 14.1 tt0 -107.51 142.1 37.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.162 -179.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.468 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.0 123.59 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-O 121.653 0.74 . . . . 0.0 111.658 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.92 105.58 0.26 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.701 -1.136 . . . . 0.0 113.002 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.61 112.68 14.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.754 0.311 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.28 171.69 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.066 0.46 . . . . 0.0 111.62 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -17.45 50.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.8 t -114.44 132.67 56.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.018 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.5 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.8 ttpp -58.24 -37.68 75.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.336 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -46.47 -32.13 3.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.109 0.48 . . . . 0.0 110.825 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.446 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 30.5 m120 -72.57 -49.58 31.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.35 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.407 ' HB3' ' CG1' ' A' ' 75' ' ' VAL . . . -57.46 -44.74 85.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.157 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -59.71 -50.35 74.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.826 0.346 . . . . 0.0 110.987 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.0 m -60.17 -35.23 74.88 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.806 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.492 ' HB3' ' CG2' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -52.01 27.54 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-O 121.811 0.815 . . . . 0.0 109.989 179.493 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.485 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.6 -58.72 6.38 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.179 -1.373 . . . . 0.0 111.066 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.27 -36.42 52.7 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.385 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt180 -65.82 -39.17 90.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.702 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -63.99 -41.16 97.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.574 178.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 36.8 mttm -61.88 -46.07 91.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.751 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -70.16 -25.48 63.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.806 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.07 -23.11 52.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.239 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.15 24.0 5.29 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.407 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.555 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.31 147.82 52.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 13.0 t70 -92.31 74.44 5.32 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.689 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.473 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -84.89 142.71 29.51 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.105 0.479 . . . . 0.0 111.908 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -133.94 153.04 35.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.855 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.407 ' CG1' ' HB3' ' A' ' 59' ' ' ALA . 79.0 t -102.83 136.06 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.955 0.407 . . . . 0.0 111.123 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt . . . . . 0 C--O 1.234 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.106 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.515 -0.396 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.8 m-85 -101.33 106.66 17.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 110.097 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -124.84 154.06 41.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.462 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.477 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.57 139.73 27.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.33 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -131.79 133.09 44.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.733 0.301 . . . . 0.0 111.058 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.477 HD12 HG11 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.58 -5.46 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -179.048 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.57 175.45 28.51 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 119.123 -1.513 . . . . 0.0 114.553 178.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.81 145.36 24.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.946 -0.627 . . . . 0.0 109.342 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -149.11 153.1 37.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.123 0.487 . . . . 0.0 111.531 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -61.42 -16.78 50.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.255 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -106.93 129.25 60.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 112.182 -179.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.6 OUTLIER -70.57 -39.89 73.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.316 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.03 -32.84 66.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 0.0 109.9 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -76.58 -34.66 58.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.254 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.65 -18.47 61.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.826 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -37.7 21.01 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.513 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.6 t -66.02 -38.04 87.43 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.452 ' CG ' HG13 ' A' ' 14' ' ' ILE . 57.3 tp -65.6 -51.34 60.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.058 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.04 -23.91 56.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.493 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.0 t -72.8 -41.25 65.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.545 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -59.55 -47.97 83.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.541 179.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.466 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.55 -41.22 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.605 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.91 -37.43 66.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.36 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.06 69.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.359 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 12.6 mmtt -62.29 -28.28 69.61 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.72 31.33 3.21 Favored Glycine 0 N--CA 1.442 -0.918 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.608 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -101.6 158.81 15.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.915 0.388 . . . . 0.0 110.853 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.92 93.94 9.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.816 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.6 p -80.4 157.94 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.997 0.427 . . . . 0.0 110.813 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -158.48 140.7 5.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.92 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.572 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.37 117.46 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.07 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.333 -0.137 0 CA-C-O 120.996 0.427 . . . . 0.0 110.647 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 30.5 m-85 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.572 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.04 147.66 29.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.172 0.51 . . . . 0.0 111.955 -179.159 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.477 HG11 HD12 ' A' ' 14' ' ' ILE . 94.9 t -120.29 104.19 15.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -109.6 141.26 42.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.359 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.46 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.3 123.7 39.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.602 0.715 . . . . 0.0 111.597 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.48 108.97 0.29 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.925 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.71 112.87 13.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.728 0.299 . . . . 0.0 110.377 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.16 170.38 14.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 111.432 -179.285 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 t -79.64 -18.27 51.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.027 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -115.33 137.87 51.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.92 0.39 . . . . 0.0 111.109 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -61.49 -38.9 88.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.634 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -45.83 -31.77 2.25 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.962 0.411 . . . . 0.0 111.016 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.433 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 62.7 m-80 -73.14 -49.06 30.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.4 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -57.12 -43.3 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.991 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -60.91 -49.35 77.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.811 0.338 . . . . 0.0 110.938 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.1 m -61.17 -33.86 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.489 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -71.52 -52.49 18.02 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 121.739 0.78 . . . . 0.0 109.934 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.477 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.98 -57.86 9.96 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.787 -178.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.17 -37.72 55.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.41 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.1 ttt85 -65.21 -37.94 88.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.821 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.455 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.52 -42.83 91.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.611 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.3 mmmm -61.34 -46.56 89.74 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.854 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -70.24 -25.41 63.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.738 178.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.424 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.77 -22.96 53.0 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.56 23.43 5.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.483 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.585 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.87 148.12 52.6 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 32.4 t70 -91.89 75.04 5.65 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.565 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -85.63 141.69 29.61 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.846 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.2 pp -133.27 153.04 36.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.911 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.4 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 76.9 t -104.86 137.18 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.031 0.443 . . . . 0.0 111.14 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.7 pt . . . . . 0 C--O 1.236 0.367 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.208 179.896 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.516 -0.351 0 CA-C-O 120.742 0.306 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.8 m-85 -102.32 106.48 17.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.114 0.483 . . . . 0.0 109.968 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.6 mttt -124.51 154.78 40.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.467 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -104.68 145.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.309 179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -137.78 134.01 34.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.5 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.2 -5.41 10.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.77 169.47 27.31 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 119.256 -1.45 . . . . 0.0 114.623 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -150.93 140.75 21.85 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -151.38 150.08 30.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 111.291 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -13.81 17.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.478 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.05 128.9 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-O 120.897 0.38 . . . . 0.0 111.794 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HD2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -71.8 -40.97 68.83 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.682 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.92 -29.51 20.46 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.232 0.539 . . . . 0.0 109.725 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -81.82 -31.88 31.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.726 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.76 -23.08 58.48 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.03 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -83.02 -40.36 20.04 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.624 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -37.29 86.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.211 0.529 . . . . 0.0 109.775 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.537 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 31.2 tp -68.21 -47.53 67.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.279 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.58 -25.85 63.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.046 0.45 . . . . 0.0 110.503 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -74.75 -41.08 60.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.045 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.537 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.05 -48.71 80.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.813 0.34 . . . . 0.0 110.627 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.503 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.88 -38.18 89.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.382 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -54.63 -36.88 64.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.398 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.99 -50.17 64.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.434 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.521 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.32 -28.0 69.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.27 32.25 3.53 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.188 -0.914 . . . . 0.0 112.383 179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 7.0 m-85 -99.18 154.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.973 0.416 . . . . 0.0 110.724 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -81.54 92.51 6.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.004 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 93.5 p -79.69 155.25 28.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.123 0.487 . . . . 0.0 110.927 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.39 140.92 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.822 -178.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.599 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 42.3 t -118.59 118.17 57.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.118 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.103 0 CA-C-O 121.065 0.46 . . . . 0.0 110.561 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' ' HD2' ' A' ' 20' ' ' LYS . 30.6 m-85 . . . . . 0 C--O 1.231 0.119 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.599 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -109.22 151.18 26.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.161 0.505 . . . . 0.0 111.784 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' A' ' 26' ' ' LEU . 86.5 t -123.9 102.19 10.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.565 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.7 141.98 37.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.89 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.482 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -134.55 123.1 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.61 0.719 . . . . 0.0 111.246 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.415 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.45 104.63 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.849 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.73 124.02 40.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.646 0.26 . . . . 0.0 110.666 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.04 174.36 10.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.036 0.446 . . . . 0.0 111.404 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -83.49 -16.7 44.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.74 130.59 56.41 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.977 0.418 . . . . 0.0 111.172 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.493 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.69 -34.66 67.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.164 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -52.34 -32.57 38.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 0.0 111.07 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.443 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 2.6 m120 -70.26 -48.45 56.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.693 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.422 ' HB2' ' CG1' ' A' ' 75' ' ' VAL . . . -61.24 -39.98 92.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.841 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -60.16 -51.78 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 62' ' ' LEU . 15.4 t -58.91 -34.75 72.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 0.0 110.855 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.4 -50.96 33.15 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.741 0.781 . . . . 0.0 110.049 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.489 ' CA ' HG12 ' A' ' 12' ' ' VAL . . . -53.0 -58.19 7.8 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.044 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.6 -35.46 65.84 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.65 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -63.96 -40.9 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 179.083 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.478 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.35 -40.07 95.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.451 178.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.0 mmmm -61.71 -47.24 86.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.719 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -26.34 65.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.809 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.455 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.67 -21.93 54.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.587 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.66 23.21 5.74 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.385 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.607 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.58 148.97 52.44 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 8.3 t0 -92.08 74.72 5.51 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.807 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.5 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -86.8 143.16 27.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.911 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -136.46 162.95 34.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.7 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.422 ' CG1' ' HB2' ' A' ' 59' ' ' ALA . 95.7 t -111.58 136.77 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.959 0.409 . . . . 0.0 111.013 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.12 -179.829 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mp . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.503 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -100.9 107.28 18.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.146 0.498 . . . . 0.0 110.018 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -127.2 155.74 42.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.596 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.47 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.1 137.58 38.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.2 179.829 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -130.36 133.3 46.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.336 . . . . 0.0 111.024 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.484 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -104.8 -4.79 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.67 174.73 28.76 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 119.05 -1.548 . . . . 0.0 114.674 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.34 140.37 21.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -144.75 148.84 34.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.834 0.35 . . . . 0.0 111.401 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -61.06 -14.42 23.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.448 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.2 t -107.17 128.94 61.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.092 0.472 . . . . 0.0 111.92 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.4 OUTLIER -68.72 -42.74 77.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.579 179.655 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.87 -32.04 60.33 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 109.852 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -77.45 -35.16 54.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.315 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.31 -18.97 61.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.771 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.81 -37.62 20.55 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.488 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.4 t -65.03 -37.0 86.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.546 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 33.7 tp -68.49 -50.41 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.198 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.45 -26.07 52.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -40.49 60.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.146 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.546 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.65 -48.71 80.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.919 0.39 . . . . 0.0 110.665 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.535 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -61.72 -39.06 90.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.359 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -54.67 -37.13 65.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.336 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.11 -49.59 68.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.425 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.0 mmtt -62.28 -28.3 69.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.29 32.88 3.09 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.473 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.499 ' CD2' HD13 ' A' ' 62' ' ' LEU . 7.3 m-85 -101.82 159.08 15.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.983 0.421 . . . . 0.0 110.682 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -87.04 94.69 9.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.879 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 87.4 p -80.38 157.04 26.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.09 0.472 . . . . 0.0 110.818 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.91 141.69 6.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.771 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 20.6 t -119.69 117.93 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.494 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.113 0 CA-C-O 120.874 0.369 . . . . 0.0 110.77 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.47 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.1 m-85 . . . . . 0 N--CA 1.461 0.078 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.607 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -105.08 147.79 27.51 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.17 0.509 . . . . 0.0 112.022 -179.473 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.482 HG11 HD13 ' A' ' 14' ' ' ILE . 93.7 t -120.67 101.64 11.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.362 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -109.02 142.25 39.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.595 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.469 HG12 ' CD1' ' A' ' 14' ' ' ILE . 1.8 pp -135.14 123.38 39.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.539 0.685 . . . . 0.0 111.5 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.24 105.64 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 114.827 -1.078 . . . . 0.0 113.054 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.57 116.36 19.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.778 0.323 . . . . 0.0 110.232 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.58 173.53 11.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.027 0.441 . . . . 0.0 111.604 -179.158 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.42 -17.85 40.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.07 131.92 56.21 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.888 0.375 . . . . 0.0 111.078 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.503 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -58.66 -38.96 79.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.397 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -44.98 -33.89 2.21 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.963 0.411 . . . . 0.0 110.782 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.434 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 26.8 m-80 -72.47 -48.78 38.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.331 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.23 85.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.001 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.33 -50.65 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.864 0.364 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 5.2 m -58.58 -36.18 73.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.49 -51.61 34.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 121.709 0.766 . . . . 0.0 110.065 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.93 -59.54 4.59 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.026 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.96 -37.89 47.27 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.567 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.983 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.96 -42.93 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.776 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.574 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.46 -47.13 87.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.658 178.83 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -25.86 64.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.74 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.458 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.94 53.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.315 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.33 23.18 5.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.515 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.574 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.21 148.94 52.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.0 t70 -92.93 74.44 4.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.484 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.07 142.06 28.98 Favored 'General case' 0 CA--C 1.524 -0.029 0 CA-C-O 121.108 0.48 . . . . 0.0 111.751 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -133.4 149.91 31.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.03 179.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.72 136.27 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.895 0.379 . . . . 0.0 111.078 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.25 -179.973 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 CA--C 1.515 -0.386 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 45.7 m-85 -101.62 106.35 17.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.058 0.456 . . . . 0.0 109.98 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -125.68 153.18 44.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.689 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.88 136.65 39.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.164 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -129.69 134.78 47.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.808 0.337 . . . . 0.0 111.163 -179.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.473 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.07 -6.16 10.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -178.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.44 173.06 29.61 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 118.792 -1.671 . . . . 0.0 114.944 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.17 137.52 18.52 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.467 178.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 46' ' ' TYR . 1.9 m-85 -146.2 149.35 33.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.784 0.326 . . . . 0.0 111.058 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -59.69 -14.66 15.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.828 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.51 130.29 60.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.096 0.474 . . . . 0.0 112.049 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -72.23 -40.6 67.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.623 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.62 -34.18 57.62 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.303 0.573 . . . . 0.0 109.791 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -75.32 -32.67 61.02 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.212 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -20.2 60.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.034 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -83.34 -38.48 22.0 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.681 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.86 -38.23 85.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.315 0.579 . . . . 0.0 109.646 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.46 ' CG ' HG13 ' A' ' 14' ' ' ILE . 48.6 tp -65.31 -51.1 62.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.149 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.98 -24.85 63.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.574 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.377 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.451 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -59.3 -46.93 87.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.426 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.458 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -58.36 -42.65 87.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.622 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -55.34 -37.28 67.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.311 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.54 -51.54 59.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.296 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.518 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 3.5 mmpt? -63.2 -28.97 70.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.21 33.28 2.79 Favored Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.528 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.7 m-85 -101.95 160.14 14.75 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.925 0.393 . . . . 0.0 110.81 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -88.96 94.68 10.03 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.773 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 m -80.6 157.55 25.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.146 0.498 . . . . 0.0 110.861 -178.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.7 140.16 5.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.724 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -115.11 112.51 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.282 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.416 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.239 0 CA-C-O 120.998 0.428 . . . . 0.0 110.714 179.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 23.8 m-85 . . . . . 0 C--O 1.226 -0.179 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.27 155.51 29.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.967 0.413 . . . . 0.0 111.455 -179.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.417 HG21 ' HB3' ' A' ' 26' ' ' LEU . 59.3 t -125.21 109.91 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.959 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -110.09 142.05 42.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.034 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.458 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.82 122.76 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 121.601 0.715 . . . . 0.0 111.525 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.0 105.0 0.32 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.826 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.41 113.31 15.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.696 0.284 . . . . 0.0 110.429 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -132.15 173.4 11.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.23 0.538 . . . . 0.0 111.389 -179.274 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -16.27 46.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.106 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.93 129.44 56.47 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.892 0.377 . . . . 0.0 111.094 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.4 OUTLIER -56.1 -35.36 66.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.25 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.9 -32.2 31.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.451 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 11.3 m120 -70.34 -49.83 45.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.558 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.401 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -59.3 -41.25 88.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.011 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -60.22 -50.86 72.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.7 0.285 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.8 m -59.0 -36.9 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.511 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.83 -51.43 40.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 121.834 0.826 . . . . 0.0 110.17 179.375 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.488 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.61 -60.3 3.53 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.211 -1.358 . . . . 0.0 111.124 -177.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -36.97 40.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.462 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -65.41 -39.3 91.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.835 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.446 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.7 -41.92 95.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.662 179.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.4 mttt -61.59 -46.65 88.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.698 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -69.74 -25.52 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.691 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.451 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.96 -22.72 52.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.402 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 24.14 5.42 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.548 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.52 148.29 52.3 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.02 72.48 5.55 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.852 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.473 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -84.81 141.39 30.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.1 0.476 . . . . 0.0 111.722 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.462 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 6.9 pt -133.61 152.22 34.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.007 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.401 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 95.9 t -103.39 136.2 37.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.867 0.365 . . . . 0.0 111.039 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.34 -179.731 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.2 mt . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -101.83 106.72 17.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -124.8 155.65 39.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.47 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.1 OUTLIER -108.59 141.61 23.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.435 179.627 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 17.7 tt0 -134.47 134.43 41.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.729 0.3 . . . . 0.0 111.319 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.481 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -107.71 -5.11 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.14 172.08 27.99 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 119.071 -1.538 . . . . 0.0 114.82 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.437 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.29 145.51 25.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 178.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -151.63 151.62 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.004 0.431 . . . . 0.0 111.33 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -60.45 -15.46 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.422 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.7 t -106.38 128.39 60.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.001 0.429 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.24 -40.46 74.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.3 -33.08 62.96 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.267 0.556 . . . . 0.0 109.739 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -75.97 -33.83 59.77 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.264 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.91 -22.75 61.44 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.775 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.71 -37.21 31.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.596 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -38.58 89.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.215 0.531 . . . . 0.0 109.758 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.522 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 15.2 tp -66.93 -47.28 72.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.23 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.27 -25.61 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 110.578 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -40.52 57.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.018 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -60.25 -48.4 81.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.339 . . . . 0.0 110.626 -179.924 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.512 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.5 -38.76 91.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.255 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -54.96 -36.58 65.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.278 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.62 73.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.229 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.3 -28.17 69.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 31.14 3.55 Favored Glycine 0 N--CA 1.442 -0.936 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.497 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.502 ' CD2' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -100.37 156.92 16.98 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.794 0.331 . . . . 0.0 110.711 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.83 95.41 9.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.999 179.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.1 p -80.24 155.85 27.14 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.201 0.524 . . . . 0.0 111.044 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -155.47 139.88 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.548 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.597 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.8 t -117.87 116.3 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.543 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.406 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.333 -0.142 0 CA-C-O 120.864 0.364 . . . . 0.0 110.458 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 22.7 m-85 . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.769 0.319 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.597 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.32 149.4 28.7 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.107 0.48 . . . . 0.0 111.268 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.438 HG21 ' HB3' ' A' ' 26' ' ' LEU . 58.7 t -122.04 100.45 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.609 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 4.5 tt0 -104.75 142.01 35.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.78 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.447 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.03 122.76 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.438 0.637 . . . . 0.0 111.425 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.42 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 82.01 107.38 0.4 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.78 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.7 121.06 29.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.258 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -141.19 172.31 12.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.111 0.481 . . . . 0.0 111.424 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -83.99 -16.22 44.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.221 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 m -111.63 127.49 55.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.84 0.352 . . . . 0.0 111.198 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -54.82 -36.49 65.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -52.97 -30.03 32.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.417 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -71.81 -49.61 37.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.639 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.41 -40.87 95.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.937 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.24 -50.7 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 m -58.38 -36.57 73.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.674 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.502 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -69.24 -50.04 50.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.746 0.784 . . . . 0.0 110.065 179.355 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.469 ' CA ' HG13 ' A' ' 12' ' ' VAL . . . -53.76 -59.22 4.9 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.284 -1.325 . . . . 0.0 111.135 -177.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.49 -36.1 63.8 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.792 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -40.82 97.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.961 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.472 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -63.81 -39.22 93.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.495 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.591 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.8 mttm -62.66 -46.66 87.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.569 178.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -26.23 64.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.734 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.59 -22.26 54.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.508 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.7 23.15 5.75 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.591 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.33 148.56 52.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.481 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 10.0 t70 -91.93 74.63 5.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.752 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.86 142.0 29.2 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.151 0.5 . . . . 0.0 112.117 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -134.07 160.98 41.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.748 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 98.5 t -113.1 137.58 45.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.904 0.383 . . . . 0.0 111.072 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.2 pt . . . . . 0 C--O 1.236 0.392 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.454 -179.942 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.519 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.9 m-85 -102.35 106.08 16.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.119 0.485 . . . . 0.0 110.172 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -125.14 153.46 42.98 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.474 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.97 139.99 26.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.342 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -134.33 134.35 41.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.617 0.246 . . . . 0.0 111.236 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.466 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.4 -4.8 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.128 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.58 175.87 29.0 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 118.993 -1.575 . . . . 0.0 114.757 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.43 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.78 148.47 27.9 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -152.76 151.88 31.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.959 0.409 . . . . 0.0 111.441 -179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.65 -14.82 22.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.421 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.46 127.76 64.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.143 0.497 . . . . 0.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.86 -38.21 73.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.344 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -33.57 67.94 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.172 0.511 . . . . 0.0 109.658 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -75.62 -33.5 60.51 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.115 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.74 -18.54 60.97 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.798 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.55 -36.96 21.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.478 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -38.05 84.19 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.453 ' CG ' HG13 ' A' ' 14' ' ' ILE . 49.0 tp -66.22 -51.6 56.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.105 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.23 -24.37 59.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.306 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -41.04 67.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.587 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.53 -46.95 87.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.45 179.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.463 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.45 -41.18 93.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.45 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -55.05 -36.86 66.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.55 -51.44 62.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.303 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.0 mmpt? -62.6 -28.61 70.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.55 32.83 2.83 Favored Glycine 0 N--CA 1.443 -0.854 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.585 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.496 ' CD2' HD11 ' A' ' 62' ' ' LEU . 4.9 m-85 -101.2 158.51 15.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.698 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -87.38 94.93 9.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.923 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.7 p -80.56 157.01 26.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.15 0.5 . . . . 0.0 110.972 -178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.59 141.08 6.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.643 -178.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.88 116.56 52.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.51 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.407 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.428 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.6 m-85 . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.83 146.81 31.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.065 0.459 . . . . 0.0 111.248 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.432 HG11 HD11 ' A' ' 14' ' ' ILE . 72.8 t -117.74 100.33 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.58 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -104.89 140.37 38.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.136 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.457 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.34 123.07 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.562 0.696 . . . . 0.0 111.57 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.401 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.71 106.99 0.25 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 114.739 -1.119 . . . . 0.0 112.879 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.13 115.58 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 110.484 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -134.27 173.5 11.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.227 0.537 . . . . 0.0 111.495 -179.252 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.52 -16.35 45.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.157 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.02 129.2 56.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.829 0.347 . . . . 0.0 111.081 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.519 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.9 OUTLIER -56.25 -35.15 67.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.221 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -52.44 -30.8 31.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.449 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 27.9 m120 -71.86 -49.92 33.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.71 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.24 91.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.28 -51.01 71.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.998 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.69 -34.81 73.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.94 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.496 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.32 -51.6 28.96 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.804 0.811 . . . . 0.0 109.892 179.425 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.49 -58.91 5.63 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.932 -178.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.32 -37.28 55.44 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.476 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -64.69 -38.93 92.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.823 178.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.67 -41.13 96.3 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.553 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 48.0 mttm -61.85 -46.8 87.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.654 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.66 -25.68 64.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.818 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.45 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.79 -22.41 53.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.278 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.34 24.18 5.47 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.421 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.74 147.98 52.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 23.0 t70 -91.58 73.42 5.93 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.607 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.466 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -83.99 140.92 31.58 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.16 0.505 . . . . 0.0 111.859 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pp -132.07 150.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.88 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.6 t -104.12 134.83 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.848 0.356 . . . . 0.0 110.966 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 pt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.127 -179.889 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 CA--C 1.514 -0.419 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.517 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.2 m-85 -101.76 106.53 17.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.177 0.513 . . . . 0.0 110.127 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -126.15 153.24 44.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.344 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.51 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.21 138.44 31.63 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.145 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 16.1 tt0 -132.12 133.38 44.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.717 0.294 . . . . 0.0 111.127 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.488 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -107.34 -4.97 10.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.275 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.56 171.04 28.24 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 119.152 -1.499 . . . . 0.0 115.034 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.449 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 144.46 24.89 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 178.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -152.84 151.05 29.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.534 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.46 -15.33 16.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.598 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.63 128.35 61.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.95 0.405 . . . . 0.0 111.8 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.47 -39.1 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.45 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -32.69 63.56 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -76.34 -32.89 58.92 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.183 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.99 -23.6 61.44 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.722 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -37.46 30.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.717 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -65.48 -38.9 91.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.237 0.541 . . . . 0.0 109.877 179.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.544 ' HG ' HG11 ' A' ' 48' ' ' VAL . 14.7 tp -66.99 -45.91 76.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.232 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.25 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.058 0.456 . . . . 0.0 110.537 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.69 -40.87 61.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.041 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.533 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.6 -48.43 81.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.758 0.313 . . . . 0.0 110.642 179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.521 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.25 -38.26 88.57 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.282 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -54.9 -37.02 65.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.232 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.72 67.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.423 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.51 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.35 -28.28 69.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.42 33.37 3.16 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.438 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 7.3 m-85 -100.75 156.28 17.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.94 0.4 . . . . 0.0 110.779 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.02 94.51 8.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.84 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.9 p -80.23 155.51 27.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.206 0.527 . . . . 0.0 111.126 -178.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.62 137.7 7.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.717 -178.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.545 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -117.6 115.69 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.38 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.402 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.334 -0.091 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.5 m-85 . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.82 149.62 28.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.186 0.517 . . . . 0.0 111.412 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.544 HG11 ' HG ' ' A' ' 26' ' ' LEU . 42.6 t -122.54 99.37 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.445 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 0.4 OUTLIER -104.66 142.22 35.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.984 -179.282 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.481 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -134.55 122.59 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 111.396 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.435 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.96 104.81 0.26 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 114.818 -1.083 . . . . 0.0 112.867 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.24 125.4 40.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -144.25 173.67 11.56 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.135 0.493 . . . . 0.0 111.574 -179.337 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 97.1 p -83.47 -16.59 45.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.062 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.42 129.74 56.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.886 0.374 . . . . 0.0 111.078 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.9 -34.85 68.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.237 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -51.52 -31.9 25.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.883 0.373 . . . . 0.0 111.134 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.44 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 73.3 m-80 -71.68 -49.57 38.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.697 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.45 -43.32 96.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.44 -51.44 69.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.931 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 70.6 m -57.88 -37.15 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.878 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.5 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.77 -51.12 44.45 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.714 0.768 . . . . 0.0 110.304 179.555 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.51 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.02 -59.67 4.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.099 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.73 -36.6 57.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.507 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.26 -39.6 94.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.765 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.461 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.64 -40.46 95.49 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.533 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.7 mttm -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.588 178.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -68.58 -25.94 65.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.846 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.458 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.97 -22.26 53.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.5 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 23.13 5.88 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.418 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.567 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.34 148.96 52.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.379 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.488 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.6 t70 -92.63 74.67 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.958 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.37 140.67 30.58 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.105 0.478 . . . . 0.0 111.907 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 11.3 pt -132.89 150.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.969 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 99.3 t -103.91 136.83 35.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.077 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 C--O 1.236 0.374 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.347 -179.836 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.4 m-85 -101.5 106.62 17.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.088 0.47 . . . . 0.0 109.896 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -125.54 152.46 45.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.451 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.59 136.65 38.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.283 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -128.06 135.48 49.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.598 0.237 . . . . 0.0 111.111 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -107.32 -6.14 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.61 173.08 29.82 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 118.795 -1.669 . . . . 0.0 115.374 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.34 142.68 23.38 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 114.62 -0.79 . . . . 0.0 108.949 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -153.33 150.38 28.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.949 0.405 . . . . 0.0 111.331 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -59.89 -15.38 21.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.617 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -107.88 127.27 64.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.005 0.431 . . . . 0.0 111.826 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.33 -38.26 68.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.658 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.29 -34.92 61.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.249 0.547 . . . . 0.0 109.591 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -73.98 -32.37 63.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.124 178.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.78 -19.99 60.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.978 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -82.12 -38.72 24.35 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.733 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -36.75 79.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.245 0.545 . . . . 0.0 109.799 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.456 ' CG ' HG13 ' A' ' 14' ' ' ILE . 51.0 tp -65.52 -51.95 56.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.472 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.11 -28.48 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -41.7 85.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.617 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.481 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -59.8 -47.92 83.78 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.692 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.481 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -58.76 -42.1 88.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.673 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.9 -37.17 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.395 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.23 -51.11 63.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.344 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpt? -62.61 -28.76 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.3 32.78 2.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.488 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.0 m-85 -102.11 159.82 15.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.959 0.409 . . . . 0.0 110.716 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -88.33 94.88 9.98 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.907 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.2 p -80.69 156.62 26.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.155 0.503 . . . . 0.0 110.91 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.92 135.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -112.06 112.04 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.111 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.546 ' O ' ' HD3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.857 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.427 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 26.2 m-85 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -119.08 156.52 29.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.986 0.422 . . . . 0.0 110.806 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' A' ' 26' ' ' LEU . 58.7 t -124.62 109.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.357 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -107.41 140.99 39.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.473 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.472 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.71 122.95 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.536 0.684 . . . . 0.0 111.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.413 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.58 104.96 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.871 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.95 112.65 14.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -130.39 171.05 13.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.078 0.466 . . . . 0.0 111.472 -179.188 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 t -80.83 -17.75 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.032 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -113.16 130.92 56.05 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.81 0.338 . . . . 0.0 111.053 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.9 ttpt -57.08 -38.85 73.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.72 -31.38 2.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.099 0.476 . . . . 0.0 110.776 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.446 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 33.4 m120 -72.21 -49.76 32.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.319 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.415 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -56.87 -43.32 81.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.118 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.29 -49.61 76.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.861 0.362 . . . . 0.0 110.843 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.7 m -60.18 -35.43 75.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.29 -52.87 19.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.874 0.845 . . . . 0.0 110.147 179.371 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.48 -58.92 5.57 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.899 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.63 -37.76 51.68 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt-85 -65.29 -37.97 88.8 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.798 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.42 -42.5 92.42 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.783 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 18.6 mttm -61.54 -46.51 89.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.696 178.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.78 -25.34 63.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.658 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.456 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.39 -23.17 50.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.283 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.05 23.97 5.33 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.524 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.04 148.76 52.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.467 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 12.8 t70 -92.24 73.48 5.38 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.446 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -86.1 140.42 30.24 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.079 0.466 . . . . 0.0 111.681 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -132.87 152.35 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.003 179.211 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.415 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 86.7 t -101.65 138.04 27.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.943 0.401 . . . . 0.0 111.051 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.0 pt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.252 -179.986 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 CA--C 1.517 -0.323 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -101.39 106.29 17.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.016 0.436 . . . . 0.0 110.209 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.33 154.37 43.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.607 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.485 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.31 140.03 25.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.277 179.821 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -132.09 136.95 47.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.743 0.306 . . . . 0.0 111.145 -179.13 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.476 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.97 -6.28 11.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -179.037 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.78 172.71 29.52 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.892 -1.623 . . . . 0.0 115.021 178.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.97 134.34 16.2 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 114.856 -0.672 . . . . 0.0 109.474 178.406 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 46' ' ' TYR . 2.6 m-85 -143.34 149.0 37.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -12.0 12.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.894 -179.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.55 129.06 63.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.951 0.405 . . . . 0.0 112.033 -179.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.4 ttpt -70.31 -41.53 73.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.684 179.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.38 -33.71 54.82 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.217 0.532 . . . . 0.0 109.803 179.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -76.48 -32.29 58.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.321 178.459 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.68 -21.18 60.34 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.98 179.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -83.68 -38.03 22.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.2 t -67.07 -37.21 83.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.187 0.518 . . . . 0.0 109.648 179.061 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.459 ' CG ' HG13 ' A' ' 14' ' ' ILE . 44.3 tp -66.98 -51.89 49.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.3 -24.3 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 178.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -72.44 -41.36 66.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.635 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -59.27 -46.93 87.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.532 179.696 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.463 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -61.54 -40.66 95.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -36.91 66.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.38 179.73 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.7 -51.42 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.31 179.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.63 -28.52 69.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.692 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.28 32.71 2.92 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.65 179.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.487 ' CD2' HD13 ' A' ' 62' ' ' LEU . 4.8 m-85 -100.71 156.48 17.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.56 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -85.3 94.54 8.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 p -80.03 155.54 27.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.919 -178.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.35 135.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.741 -178.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.2 t -112.91 111.01 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.127 179.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 121.013 0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.0 m-85 . . . . . 0 C--O 1.227 -0.118 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.14 155.39 29.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 111.409 -179.547 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 26' ' ' LEU . 60.2 t -126.46 108.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.358 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -109.77 143.26 39.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.696 -179.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.47 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.6 pp -135.42 123.54 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.521 0.677 . . . . 0.0 111.746 179.799 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.4 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.77 104.18 0.26 Allowed Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.968 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.73 120.58 29.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.676 0.274 . . . . 0.0 110.32 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -139.17 171.36 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.033 0.444 . . . . 0.0 111.581 -179.114 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -80.97 -17.34 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.962 179.53 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.01 131.58 56.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.025 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.2 ttpt -57.8 -37.63 74.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -46.18 -32.77 3.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.041 0.448 . . . . 0.0 110.988 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 45.9 m-80 -71.83 -49.61 36.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.416 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -57.6 -44.18 85.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.206 179.581 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.79 -51.92 67.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.757 0.313 . . . . 0.0 111.192 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.59 -34.11 72.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.059 -179.871 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.487 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.92 -53.2 15.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.83 0.824 . . . . 0.0 110.138 179.561 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.485 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.75 -58.56 6.79 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.911 -178.041 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.37 -37.67 56.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.396 179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.0 ttt180 -64.64 -37.65 88.29 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.788 178.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.62 -42.29 91.71 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.721 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 20.7 mttt -61.53 -46.61 89.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.682 178.71 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -69.88 -25.32 63.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.445 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.6 -23.25 49.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.217 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.38 24.25 5.13 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.533 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.87 148.84 52.57 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.302 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.433 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 22.5 t0 -92.63 74.28 5.06 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.727 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.476 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -87.61 142.1 28.1 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.183 0.516 . . . . 0.0 111.705 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pp -134.72 153.57 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.801 178.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.416 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 79.6 t -101.12 136.53 32.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.946 0.403 . . . . 0.0 111.041 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.2 pt . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.39 -179.902 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 CA--C 1.514 -0.424 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.31 106.85 18.08 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.105 0.479 . . . . 0.0 110.085 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -126.78 154.18 44.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.446 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -109.28 135.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.141 179.701 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -127.68 138.14 52.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.542 0.21 . . . . 0.0 111.07 -179.356 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.518 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -108.16 -4.59 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.923 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.38 176.27 30.24 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 118.609 -1.758 . . . . 0.0 115.352 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.62 143.94 24.07 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.596 -0.802 . . . . 0.0 108.999 178.024 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -152.95 144.07 23.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.954 0.407 . . . . 0.0 111.635 -179.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -17.29 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.187 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.28 127.57 62.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.284 0.564 . . . . 0.0 112.175 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tmtt? -70.16 -41.78 73.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.634 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.03 -35.51 47.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.301 0.572 . . . . 0.0 109.763 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -74.47 -32.8 62.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.221 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.72 -27.36 63.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.81 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.83 -37.32 55.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -34.31 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.196 0.522 . . . . 0.0 109.877 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.529 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 19.0 tp -69.73 -51.98 29.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.465 179.566 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.95 -26.41 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.0 110.663 179.227 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.2 m -73.95 -40.81 62.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.104 179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.553 ' ND2' ' N ' ' A' ' 30' ' ' ALA . 0.3 OUTLIER -60.3 -49.4 77.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.745 -179.926 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.553 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -60.85 -39.42 89.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.294 179.542 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.83 -36.21 64.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.2 179.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -50.13 68.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.268 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 2.1 mmtt -62.54 -28.61 69.97 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.731 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.54 33.56 2.87 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.609 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.512 ' CD2' HD11 ' A' ' 62' ' ' LEU . 6.7 m-85 -101.46 157.6 16.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 110.736 179.564 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.69 93.3 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.879 179.254 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.6 p -80.5 157.15 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.151 0.501 . . . . 0.0 111.136 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.98 140.07 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.429 -178.768 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -118.5 116.61 51.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.565 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.42 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.616 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.474 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.3 m-85 . . . . . 0 C--O 1.225 -0.228 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.47 151.82 25.05 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.128 0.489 . . . . 0.0 111.496 -179.713 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.47 HG13 ' HG ' ' A' ' 26' ' ' LEU . 52.7 t -125.77 106.73 16.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.084 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 13.6 tt0 -105.66 141.08 37.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.437 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 1.7 pp -134.6 123.59 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.524 0.678 . . . . 0.0 111.392 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.422 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.59 108.73 0.29 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 114.798 -1.092 . . . . 0.0 113.14 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.56 124.11 26.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -143.2 175.76 9.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 111.599 -179.18 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -84.52 -18.81 34.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.02 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.38 129.52 55.99 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.888 0.375 . . . . 0.0 111.084 -179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtm? -56.49 -36.87 69.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.52 -179.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -50.69 -31.69 17.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.865 0.364 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.434 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 27.3 m-80 -71.34 -49.38 43.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.699 179.925 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.21 97.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.66 -52.05 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 110.835 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.9 m -55.45 -39.87 70.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.512 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -66.86 -50.37 62.72 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.737 0.779 . . . . 0.0 110.59 179.608 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.416 ' CB ' HG11 ' A' ' 12' ' ' VAL . . . -52.03 -62.04 1.88 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.382 -177.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.87 -35.2 61.29 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.939 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.1 ttt180 -63.67 -40.59 97.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.003 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.474 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.06 -40.97 95.51 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.741 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.9 mttm -61.67 -47.56 84.8 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.653 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -68.7 -25.87 65.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.79 178.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.455 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.35 -22.13 52.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.584 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.35 23.78 5.62 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.586 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.546 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.0 149.89 52.41 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.294 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.518 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 9.2 t0 -92.3 73.75 5.33 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.961 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -87.3 140.09 29.89 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.042 0.448 . . . . 0.0 111.887 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.1 pt -133.7 153.14 36.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.891 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.3 t -105.77 138.6 30.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.005 0.431 . . . . 0.0 110.97 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 pt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.405 -179.957 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 CA--C 1.516 -0.352 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.53 106.93 18.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.1 0.476 . . . . 0.0 110.017 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -127.98 155.32 44.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.443 179.57 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.481 HG12 ' CA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -108.45 137.82 38.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.364 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 60.9 tt0 -128.91 135.29 48.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.906 -179.436 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.509 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -107.79 -4.69 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -178.777 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.26 175.99 29.81 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.616 -1.754 . . . . 0.0 115.273 178.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.67 144.37 24.32 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.247 178.06 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.69 144.21 23.4 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.988 0.423 . . . . 0.0 111.51 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -16.27 1.76 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.202 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -108.45 127.88 64.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 112.236 -179.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.448 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.3 ttpt -69.83 -42.03 74.16 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.636 179.588 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -35.28 49.53 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.183 0.515 . . . . 0.0 109.758 179.108 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -74.6 -33.08 62.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.303 178.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.76 -25.76 63.05 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.749 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.16 -36.63 47.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -66.48 -35.4 80.19 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.528 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 19.8 tp -69.02 -52.57 27.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.442 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.07 -25.96 47.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.482 . . . . 0.0 110.647 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.8 t -74.66 -40.4 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.544 ' ND2' ' N ' ' A' ' 30' ' ' ALA . 0.3 OUTLIER -60.64 -48.9 79.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.62 -179.883 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.544 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -61.16 -39.63 90.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.157 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.56 -36.1 63.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.279 179.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.67 -51.6 62.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.66 -28.72 70.11 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.746 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.03 34.82 2.47 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.662 178.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -101.83 159.07 15.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.911 0.386 . . . . 0.0 110.723 179.391 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.44 94.43 9.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.12 179.382 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.7 p -80.55 156.83 26.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.223 0.535 . . . . 0.0 110.965 -178.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -156.2 137.87 5.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.525 -178.706 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 19.6 t -116.22 114.43 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.567 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.414 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.333 -0.142 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.58 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.0 m-85 . . . . . 0 C--O 1.225 -0.19 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.79 151.7 25.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.183 0.516 . . . . 0.0 111.512 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.455 HG11 ' HG ' ' A' ' 26' ' ' LEU . 51.0 t -125.45 105.53 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.068 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 7.5 tt0 -104.3 141.54 36.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.444 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 1.7 pp -134.57 123.57 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.46 0.647 . . . . 0.0 111.593 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.422 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.37 107.38 0.23 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.208 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -131.96 123.46 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.34 175.16 9.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.176 0.512 . . . . 0.0 111.649 -179.224 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 p -83.43 -18.75 37.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.009 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.49 129.32 56.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.955 0.407 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -55.49 -35.9 66.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.258 -179.876 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -50.21 -32.62 16.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.453 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 9.5 m120 -70.79 -50.15 38.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.66 -44.72 93.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.169 179.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -57.57 -52.84 63.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 0.0 110.884 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.9 m -55.67 -38.94 70.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.908 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.506 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -67.02 -51.08 59.3 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.788 0.804 . . . . 0.0 110.475 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.481 ' CA ' HG12 ' A' ' 12' ' ' VAL . . . -53.24 -61.56 2.22 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.279 -177.573 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.81 -36.91 49.57 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -63.63 -39.54 94.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.859 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.459 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.94 -41.85 90.79 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.732 179.032 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.5 mttm -61.14 -48.27 82.39 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.18 -25.99 65.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.803 178.559 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.453 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -77.77 -21.04 52.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.497 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.34 24.21 5.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.518 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.548 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.35 149.81 52.4 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.162 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 46.3 t0 -92.8 73.61 4.92 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.965 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.459 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.85 139.28 31.41 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.06 0.457 . . . . 0.0 111.747 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.475 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.7 pt -132.82 149.76 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.161 179.089 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 98.4 t -101.88 137.22 30.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.93 0.395 . . . . 0.0 111.017 179.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.421 HD11 HG23 ' A' ' 76' ' ' ILE . 20.3 pt . . . . . 0 C--O 1.234 0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.237 -179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.0 mt . . . . . 0 CA--C 1.516 -0.344 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.512 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -100.93 106.77 18.13 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.117 0.484 . . . . 0.0 110.058 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.98 154.78 42.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.591 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.498 HG11 ' CA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -108.48 138.84 33.32 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.151 179.706 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 6.7 tt0 -131.35 135.43 47.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.684 0.278 . . . . 0.0 110.985 -179.211 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.479 HG13 ' CG ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -107.45 -5.41 10.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.85 175.68 30.05 Favored Glycine 0 C--N 1.338 0.664 0 C-N-CA 118.772 -1.68 . . . . 0.0 115.285 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.61 142.95 23.41 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.046 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -153.06 144.17 23.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.015 0.436 . . . . 0.0 111.625 -179.348 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.93 -16.16 1.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.02 179.761 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.03 126.7 64.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 3.9 ttpt -69.39 -41.28 76.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.381 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.87 -34.28 53.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.249 0.547 . . . . 0.0 109.647 179.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.74 -33.09 62.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.161 178.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.9 -18.64 60.88 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.016 179.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.92 -38.62 20.83 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.67 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -67.52 -37.54 82.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.284 0.564 . . . . 0.0 109.524 178.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CG ' HG13 ' A' ' 14' ' ' ILE . 54.3 tp -65.67 -51.91 55.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.992 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.21 62.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.611 179.238 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.41 -40.55 70.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.28 179.45 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.49 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -60.76 -48.44 81.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.659 179.787 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.49 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -58.53 -42.81 88.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.519 -179.871 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -55.12 -37.23 66.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.151 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.13 -51.25 64.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.361 179.395 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 14.6 mmtt -62.64 -28.86 70.21 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.67 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.22 33.56 2.51 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.752 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CD2' HD12 ' A' ' 62' ' ' LEU . 5.2 m-85 -104.22 164.22 11.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.594 179.379 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.55 92.52 8.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.939 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 m -81.22 127.37 32.61 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.288 0.566 . . . . 0.0 111.178 -178.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -124.61 139.04 52.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.671 -179.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.9 t -116.04 113.11 42.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.196 179.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.424 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.488 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.8 m-85 . . . . . 0 N--CA 1.456 -0.135 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -109.76 151.78 26.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.42 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.413 HG23 ' HB3' ' A' ' 26' ' ' LEU . 67.5 t -124.03 105.41 15.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.011 179.792 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 8.4 tt0 -104.63 141.44 36.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.516 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.456 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.6 pp -135.48 123.1 36.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.431 0.634 . . . . 0.0 111.668 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.428 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 81.39 108.13 0.35 Allowed Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.945 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.48 122.27 27.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.519 0.199 . . . . 0.0 110.468 179.586 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.47 172.64 12.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.47 . . . . 0.0 111.518 -179.295 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 t -82.87 -16.81 46.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.059 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.83 129.9 56.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.512 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.0 tmtt? -56.77 -35.31 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.264 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -50.32 -32.97 18.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 110.928 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.441 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 24.4 m-80 -70.71 -49.59 45.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.725 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.46 -42.93 93.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.117 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -58.84 -52.15 66.97 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.106 -179.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -35.79 72.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.921 -179.93 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.49 -51.51 35.28 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 121.757 0.789 . . . . 0.0 110.188 179.561 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.498 ' CA ' HG11 ' A' ' 12' ' ' VAL . . . -54.62 -60.62 3.1 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.064 -177.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.85 51.55 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.663 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -63.1 -38.16 90.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.814 178.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.68 -41.99 91.78 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.723 179.085 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 43.4 mttm -61.39 -47.59 85.13 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.621 178.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -68.91 -25.44 64.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.69 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.43 -21.96 52.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.392 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.78 24.2 5.63 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.375 -179.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.78 149.09 52.58 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -179.214 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.6 t70 -92.25 71.89 5.33 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.695 179.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.25 141.39 30.14 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-O 121.09 0.471 . . . . 0.0 111.731 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.08 152.62 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 94.0 t -104.73 135.19 43.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.875 0.369 . . . . 0.0 110.953 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.36 -179.953 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 CA--C 1.515 -0.367 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.523 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.8 m-85 -101.25 107.28 18.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.109 0.48 . . . . 0.0 109.974 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.3 mttm -126.08 155.37 41.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.4 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.1 OUTLIER -109.07 137.49 40.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.212 179.811 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tt0 -128.44 133.4 48.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.675 0.274 . . . . 0.0 111.409 -179.357 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.574 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -98.6 -5.61 9.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.13 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 151.31 -176.49 29.75 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 119.037 -1.554 . . . . 0.0 114.813 178.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -152.35 144.41 23.81 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.929 -0.636 . . . . 0.0 109.428 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -153.22 141.89 20.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.914 0.388 . . . . 0.0 111.532 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -15.57 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.892 179.793 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.35 123.31 62.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.076 0.465 . . . . 0.0 112.165 -179.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -67.19 -41.03 86.55 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.23 179.262 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.43 -31.89 47.33 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.205 0.526 . . . . 0.0 109.704 178.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -76.42 -32.38 58.44 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.263 178.336 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.21 -17.25 58.64 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.095 179.086 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -84.47 -38.68 19.84 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.339 0.59 . . . . 0.0 109.719 178.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.516 ' CD1' HG13 ' A' ' 14' ' ' ILE . 12.0 tp -66.86 -56.89 8.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.482 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -33.66 66.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.149 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 m -61.27 -40.88 95.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.41 179.614 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.55 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.5 OUTLIER -61.38 -43.38 98.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.45 179.655 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.55 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -61.39 -41.98 98.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.11 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -55.04 -35.99 65.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.137 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.4 -51.48 64.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.277 179.371 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 8.5 mmtt -62.63 -28.55 69.98 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.9 33.46 2.6 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.3 -0.863 . . . . 0.0 112.775 178.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.503 ' CD2' HD13 ' A' ' 62' ' ' LEU . 4.6 m-85 -102.37 158.92 15.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.917 0.389 . . . . 0.0 110.904 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.56 92.72 8.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.738 179.22 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.418 ' HA ' HG21 ' A' ' 50' ' ' ILE . 16.1 p -80.69 158.52 25.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.191 0.519 . . . . 0.0 111.339 -178.642 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.82 141.71 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.479 -178.818 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 23.6 t -118.84 115.84 49.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.513 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.416 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.455 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.9 m-85 . . . . . 0 C--O 1.226 -0.171 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.74 148.94 27.83 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.238 0.542 . . . . 0.0 111.752 -179.362 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.431 HG11 ' HG ' ' A' ' 26' ' ' LEU . 61.9 t -120.31 106.17 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.919 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 14.3 tt0 -105.57 139.89 39.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.001 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.456 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 1.7 pp -135.88 124.03 36.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.459 0.647 . . . . 0.0 111.64 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.21 108.99 0.28 Allowed Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.197 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.12 115.49 15.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.682 0.277 . . . . 0.0 110.425 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.55 175.93 8.99 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.057 0.456 . . . . 0.0 111.564 -179.256 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 p -84.56 -18.29 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.023 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.43 128.71 56.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.865 0.364 . . . . 0.0 111.105 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.5 tmtm? -55.59 -36.42 66.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.259 -179.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -51.65 -32.01 27.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.429 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 4.1 m120 -70.67 -49.5 46.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.418 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -59.77 -41.66 91.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.082 179.656 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -59.14 -51.5 69.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.994 -179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -36.71 71.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.832 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.46 -50.64 43.58 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.667 0.746 . . . . 0.0 110.15 179.543 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.446 ' CB ' HG13 ' A' ' 12' ' ' VAL . . . -53.44 -60.57 3.14 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.06 -177.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.66 -37.42 58.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.709 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -63.82 -38.51 91.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 0.0 109.804 179.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.455 ' CB ' ' HB2' ' A' ' 73' ' ' ALA . . . -65.3 -41.75 93.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.759 179.114 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.1 OUTLIER -62.0 -46.5 88.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.614 178.841 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.88 -25.79 64.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.642 178.253 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.451 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -76.85 -21.95 54.26 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.266 179.608 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.01 24.12 5.87 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.936 -0.649 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 0.9 OUTLIER -130.56 152.14 50.26 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.139 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.574 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 17.9 t70 -94.47 71.35 3.71 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.949 -0.301 . . . . 0.0 111.199 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.466 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -88.81 140.5 29.38 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 121.062 0.458 . . . . 0.0 111.667 179.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 13.7 pt -134.21 157.66 41.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.837 179.259 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.418 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 97.1 t -105.23 137.24 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.918 0.389 . . . . 0.0 111.158 179.888 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.393 -179.869 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.7 mt . . . . . 0 CA--C 1.517 -0.322 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.7 m-85 -101.4 106.8 17.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.011 0.434 . . . . 0.0 109.86 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.83 153.5 46.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.495 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.499 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.82 139.26 27.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.388 -179.942 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -130.42 137.52 49.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.586 0.232 . . . . 0.0 111.222 -179.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.467 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.92 -6.23 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.89 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.59 175.02 30.08 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 118.713 -1.708 . . . . 0.0 115.355 178.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.44 145.37 25.18 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.554 -0.823 . . . . 0.0 109.031 178.141 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -153.28 148.22 26.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 111.611 -179.188 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -55.61 -17.23 5.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.732 179.703 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.6 t -108.65 129.88 62.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.019 0.438 . . . . 0.0 111.948 -179.487 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -73.74 -37.68 65.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.312 179.612 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.43 64.23 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.297 0.57 . . . . 0.0 109.527 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -72.99 -32.15 64.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.986 178.107 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.4 -20.0 60.85 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.805 179.055 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -82.11 -37.33 26.46 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.726 179.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.5 t -69.35 -35.93 76.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.796 179.037 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.458 ' CG ' HG13 ' A' ' 14' ' ' ILE . 50.9 tp -66.39 -51.75 53.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.358 179.393 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.75 -27.85 65.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.097 0.475 . . . . 0.0 110.417 179.072 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 t -67.7 -41.58 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.599 179.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -60.06 -47.63 85.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.622 179.651 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.501 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.64 -41.77 95.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.525 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -54.54 -36.36 64.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.244 179.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.41 -51.4 65.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.429 179.472 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.9 mmtt -62.67 -28.81 70.18 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.678 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.01 34.63 2.52 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.636 178.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.505 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -102.66 159.44 15.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.899 0.381 . . . . 0.0 110.802 179.631 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -87.6 93.82 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.252 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.579 ' HA ' HG21 ' A' ' 50' ' ' ILE . 41.2 p -79.02 152.87 30.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.973 -178.957 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.29 135.0 6.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.525 -178.706 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 12.0 t -111.87 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.32 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.442 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.674 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 25.5 m-85 . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -116.27 154.08 30.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.983 0.42 . . . . 0.0 111.067 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.454 HG22 ' HB3' ' A' ' 26' ' ' LEU . 91.7 t -122.95 117.51 52.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.976 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -119.15 143.99 46.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.344 -179.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.579 HG21 ' HA ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -137.28 140.87 41.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.971 178.993 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.45 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 69.38 97.14 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.971 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.89 112.52 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -135.89 171.05 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 111.633 -178.802 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -79.44 -16.42 56.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.767 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.01 132.14 56.69 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.913 0.387 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.8 ttpt -58.48 -36.74 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -46.71 -32.76 3.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.458 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 5.5 m120 -71.75 -50.08 33.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.2 -43.31 82.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.02 179.523 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.58 -51.17 71.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.431 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -57.93 -38.57 76.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.848 179.957 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.505 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -67.82 -52.23 39.34 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.727 0.775 . . . . 0.0 110.395 179.509 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.492 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.04 -60.73 2.91 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.18 -177.808 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.95 -36.39 49.14 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.467 179.48 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.54 -39.89 92.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.047 179.035 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.46 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.82 -41.52 95.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.591 179.113 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.4 mttm -61.87 -47.31 85.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.661 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -69.43 -25.12 63.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.703 178.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -77.63 -22.11 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.299 179.85 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.33 23.09 5.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.843 -0.694 . . . . 0.0 111.418 -179.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.547 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.14 148.14 51.95 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -179.248 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -91.8 74.43 5.73 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.772 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.81 140.92 29.22 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.129 0.49 . . . . 0.0 111.855 179.981 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.9 pp -133.49 151.46 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.957 179.196 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 96.7 t -101.54 136.22 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.846 0.355 . . . . 0.0 110.955 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 18.6 pt . . . . . 0 C--O 1.236 0.369 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.244 -179.869 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 CA--C 1.517 -0.295 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.5 m-85 -101.28 106.01 17.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.115 0.483 . . . . 0.0 110.163 179.681 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.46 153.38 43.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.359 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.512 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.55 141.55 20.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.379 179.84 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -133.73 132.74 40.95 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.728 0.299 . . . . 0.0 111.243 -178.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.475 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.08 -5.9 10.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.057 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.96 173.02 29.06 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 118.951 -1.595 . . . . 0.0 114.778 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.499 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.03 137.26 18.42 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 114.986 -0.607 . . . . 0.0 109.625 178.45 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -146.29 150.54 35.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.873 0.368 . . . . 0.0 111.102 -179.62 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -61.31 -12.91 15.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.937 -179.87 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.36 129.46 62.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.011 0.434 . . . . 0.0 111.965 -179.402 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 ttpt -71.4 -40.1 70.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.579 179.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.15 -33.62 58.42 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -76.48 -32.03 58.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.354 178.349 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.6 60.25 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.999 179.271 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.91 -38.47 21.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.693 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -67.34 -36.71 81.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 109.696 179.104 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.464 ' CG ' HG13 ' A' ' 14' ' ' ILE . 50.9 tp -67.2 -51.57 51.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.253 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.57 -24.4 60.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.369 178.917 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -41.66 67.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.559 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.13 -47.06 86.67 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.391 179.816 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.461 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.74 -40.76 93.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.668 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -55.13 -36.91 66.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.203 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -51.35 62.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.24 179.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.48 -28.6 69.94 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.673 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.06 32.35 3.07 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.542 179.111 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.523 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.1 m-85 -100.5 156.77 17.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.897 0.38 . . . . 0.0 110.776 179.506 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.27 93.63 8.73 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.66 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 54.1 p -80.16 156.76 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.076 0.465 . . . . 0.0 111.107 -178.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.13 139.13 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.716 -178.641 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 24.0 t -113.75 110.72 33.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.18 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.192 0 CA-C-O 121.008 0.432 . . . . 0.0 110.663 179.798 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.1 m-85 . . . . . 0 C--O 1.228 -0.034 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.49 157.18 29.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.031 0.443 . . . . 0.0 111.338 -179.836 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 85.5 t -124.67 110.99 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.407 -179.701 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -110.24 141.01 43.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.422 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.505 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.11 123.1 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.45 0.643 . . . . 0.0 111.652 179.702 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.414 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.13 100.13 0.3 Allowed Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.9 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.25 123.18 40.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.369 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -142.8 170.25 16.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.122 0.486 . . . . 0.0 111.501 -179.112 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.5 p -80.47 -16.4 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.903 179.537 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.55 131.05 56.79 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.893 0.378 . . . . 0.0 110.95 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 19.5 ttpp -57.52 -36.74 71.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.404 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -46.43 -32.17 3.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.977 0.418 . . . . 0.0 110.917 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.452 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 7.9 m120 -73.79 -48.7 29.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.356 179.647 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.78 -45.62 91.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.132 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -59.07 -53.07 62.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.702 0.287 . . . . 0.0 111.22 -179.649 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 14.8 t -58.87 -34.4 71.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.938 0.399 . . . . 0.0 111.034 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.488 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.85 -52.95 20.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.87 0.843 . . . . 0.0 110.195 179.522 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.512 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -53.73 -58.49 7.01 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.97 -177.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.96 -37.28 60.99 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.468 179.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.2 ttt180 -64.16 -39.06 93.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.764 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.45 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.03 -40.44 96.33 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.45 179.075 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.02 91.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.556 178.741 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -70.25 -25.51 63.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.878 178.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.47 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.17 -22.96 51.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.374 179.784 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.31 23.67 5.38 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.547 -179.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.22 148.28 52.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 -179.245 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.3 t0 -92.31 73.72 5.32 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.779 179.594 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.475 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -84.96 142.86 29.34 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.082 0.468 . . . . 0.0 111.806 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.2 pt -134.66 153.06 34.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.1 t -103.75 135.38 41.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 111.073 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.225 -179.909 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.516 -0.339 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.3 m-85 -101.76 106.97 18.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.163 0.506 . . . . 0.0 109.937 179.582 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -125.93 152.88 45.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.349 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.518 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -104.23 142.57 17.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.171 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -135.51 134.19 39.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.853 0.359 . . . . 0.0 111.423 -178.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.475 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.23 -5.65 10.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -179.328 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.78 173.97 27.88 Favored Glycine 0 C--N 1.338 0.672 0 C-N-CA 119.215 -1.469 . . . . 0.0 114.421 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.65 147.95 27.36 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.092 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -152.22 151.64 31.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 111.268 -179.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -60.89 -14.36 21.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.345 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.93 128.43 61.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.955 0.407 . . . . 0.0 111.76 -179.75 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.407 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.8 -36.86 70.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.247 179.639 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.16 -32.6 70.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 109.779 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -76.98 -34.33 57.56 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.109 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.54 -19.39 61.52 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.659 178.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -83.73 -38.29 21.57 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.345 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.0 t -65.28 -37.03 85.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.309 0.576 . . . . 0.0 109.644 178.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.548 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 40.3 tp -67.91 -48.7 65.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.137 179.172 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.35 -26.22 60.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.143 0.497 . . . . 0.0 110.369 178.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.24 -40.45 62.39 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.07 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.548 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.32 -48.55 81.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.939 0.4 . . . . 0.0 110.633 -179.977 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.515 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.46 -38.35 89.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.84 -36.64 65.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.416 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.71 -51.42 60.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.524 179.546 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.482 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.34 -28.04 69.48 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.804 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.28 33.63 2.91 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.491 179.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.0 157.96 16.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.687 179.356 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.37 95.92 9.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.144 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 54.7 p -80.36 155.2 27.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.17 0.51 . . . . 0.0 110.973 -178.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -155.66 139.96 8.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.783 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.586 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.34 116.4 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.497 -179.712 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.904 0.383 . . . . 0.0 110.337 179.795 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.43 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 27.4 m-85 . . . . . 0 N--CA 1.457 -0.118 0 CA-C-O 120.736 0.303 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.586 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.71 148.42 30.48 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 120.996 0.427 . . . . 0.0 111.114 -179.912 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.424 HG13 HD12 ' A' ' 14' ' ' ILE . 58.0 t -120.03 99.08 6.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.648 179.606 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -102.56 140.84 36.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.701 -179.62 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.512 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -134.01 123.05 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 111.324 179.623 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.434 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 78.28 103.56 0.2 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.819 179.897 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.43 124.41 41.4 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.35 174.38 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.088 0.471 . . . . 0.0 111.606 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.17 -17.27 43.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.984 179.721 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.6 t -112.6 128.73 56.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtt? -56.68 -34.69 67.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.225 -179.881 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.51 -32.66 28.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.853 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.434 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 79.7 m-20 -70.49 -49.52 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.65 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.411 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -59.2 -41.56 88.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.91 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.95 -51.15 70.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.8 0.333 . . . . 0.0 110.804 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.0 m -58.66 -35.89 73.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 -180.0 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.07 -51.56 30.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.766 0.793 . . . . 0.0 110.161 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.518 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.65 -58.49 7.01 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.938 -177.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -36.76 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.02 -38.87 92.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.559 178.937 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.468 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.18 -40.75 94.67 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.476 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.9 mttm -62.07 -47.21 85.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.624 178.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -68.68 -25.89 65.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.66 178.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.459 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.11 -21.94 53.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.394 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.07 23.45 5.82 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.409 -179.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.86 148.55 52.64 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.354 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -92.21 74.52 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.475 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.08 142.29 28.81 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.082 0.468 . . . . 0.0 112.003 179.89 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 10.1 pt -135.53 153.09 32.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.062 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.411 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 98.3 t -103.04 135.94 38.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.903 0.382 . . . . 0.0 110.914 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.415 HG23 HD11 ' A' ' 76' ' ' ILE . 10.2 tt . . . . . 0 C--O 1.236 0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.153 -179.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.6 mt . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.491 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -101.04 106.73 18.04 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.423 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -126.51 155.85 41.69 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.532 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.482 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -107.68 138.28 34.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.29 179.845 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -130.49 134.98 47.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.767 0.318 . . . . 0.0 111.104 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.481 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.27 -5.25 10.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.145 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.62 171.15 28.45 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 119.15 -1.5 . . . . 0.0 114.687 179.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.413 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -150.62 140.95 22.33 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.476 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -149.85 149.62 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.0 111.361 -179.323 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -15.41 23.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.525 179.843 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -104.93 128.66 58.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.041 0.448 . . . . 0.0 111.765 -179.711 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.84 -38.92 70.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.452 179.772 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -32.39 65.24 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.168 0.509 . . . . 0.0 109.85 179.153 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.68 -33.86 53.15 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.25 178.511 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.8 -22.48 61.57 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.806 179.116 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -81.66 -38.83 25.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -64.0 -37.54 87.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.319 0.58 . . . . 0.0 109.72 179.021 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.542 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 27.5 tp -67.62 -46.33 72.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.206 179.357 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.35 65.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.119 0.485 . . . . 0.0 110.631 179.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -74.82 -40.62 60.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.071 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.542 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.72 -48.58 81.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.911 0.386 . . . . 0.0 110.747 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.521 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.61 -38.3 89.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.333 179.472 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -55.18 -36.61 66.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.481 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.5 -50.29 65.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.388 179.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.488 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 6.1 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.709 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 32.65 3.1 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.554 179.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD13 ' A' ' 62' ' ' LEU . 6.2 m-85 -100.89 156.8 17.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.93 0.395 . . . . 0.0 110.72 179.639 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.52 94.19 8.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.009 179.422 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 86.3 p -80.24 155.98 27.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.114 0.483 . . . . 0.0 110.968 -178.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.22 142.33 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.761 -178.525 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.603 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 35.4 t -120.21 117.86 54.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.366 -179.759 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.417 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.981 0.42 . . . . 0.0 110.572 179.681 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 31.0 m-85 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.669 0.271 . . . . 0.0 110.324 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.603 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.48 149.45 27.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.983 0.421 . . . . 0.0 111.528 -179.85 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.473 HG13 HD12 ' A' ' 14' ' ' ILE . 85.9 t -121.81 100.97 9.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.29 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -106.84 141.9 37.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.543 -178.831 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.454 HG12 ' CD1' ' A' ' 14' ' ' ILE . 1.8 pp -134.78 123.48 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-O 121.469 0.652 . . . . 0.0 111.414 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.69 105.33 0.25 Allowed Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.004 179.671 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.44 115.49 18.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.628 0.252 . . . . 0.0 110.429 179.525 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.56 171.04 14.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.045 0.45 . . . . 0.0 111.544 -179.328 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.99 -18.33 50.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.02 133.05 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.934 0.397 . . . . 0.0 111.089 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.491 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 7.7 ttpt -58.82 -38.27 78.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.443 -179.708 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.01 -32.23 2.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.998 0.427 . . . . 0.0 110.839 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.432 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 65.3 m-80 -72.52 -49.23 34.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.413 179.638 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.97 -44.66 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.255 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -59.17 -50.78 72.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 4.6 m -58.9 -36.23 74.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.793 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.34 -51.69 34.48 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.808 0.813 . . . . 0.0 110.293 179.446 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.482 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.1 -59.25 4.9 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.039 -177.983 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.41 -36.17 53.55 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.37 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.6 ttt180 -65.29 -38.95 91.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.727 178.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.449 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.72 -41.69 91.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.645 178.965 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.87 87.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.165 0.507 . . . . 0.0 109.662 178.773 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -69.34 -25.77 64.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.753 178.534 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.463 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.9 -22.65 53.08 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.91 23.9 5.41 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.481 -179.303 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.81 148.73 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.325 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.3 t0 -92.54 75.41 5.11 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.936 179.965 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.481 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.55 141.4 29.07 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 121.228 0.537 . . . . 0.0 111.931 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.6 pt -133.68 151.02 32.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.984 179.122 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.2 t -101.33 137.88 27.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.938 0.399 . . . . 0.0 111.03 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 pt . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.179 -179.936 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt . . . . . 0 CA--C 1.516 -0.337 0 CA-C-O 120.878 0.371 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.7 m-85 -101.69 106.25 17.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.838 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -125.11 152.32 44.55 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.473 179.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.48 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.17 139.87 24.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.197 179.712 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -132.61 134.56 45.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.792 0.33 . . . . 0.0 111.282 -179.135 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.77 -5.74 10.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.234 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.13 172.62 27.6 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 119.18 -1.486 . . . . 0.0 114.707 178.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.416 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.54 147.95 27.42 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.025 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -152.21 153.11 33.16 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.485 -179.293 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -59.8 -17.29 34.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.295 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.04 130.63 57.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.046 0.45 . . . . 0.0 111.915 -179.394 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -72.92 -38.21 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.231 179.515 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.18 66.24 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -75.46 -33.61 60.86 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.099 178.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.33 -20.81 61.42 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.649 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.4 -37.48 25.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.47 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.5 t -66.19 -37.23 85.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.772 179.085 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.542 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.19 -47.06 68.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.259 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.87 -26.07 65.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.055 0.455 . . . . 0.0 110.349 178.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.54 61.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.091 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.542 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.64 -48.34 82.05 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 120.863 0.363 . . . . 0.0 110.616 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.517 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.58 -38.33 89.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.243 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -54.74 -36.61 64.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.387 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.67 -51.22 61.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.472 179.483 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.45 -28.2 69.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.73 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.44 33.24 2.97 Favored Glycine 0 N--CA 1.444 -0.775 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.44 179.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD13 ' A' ' 62' ' ' LEU . 5.9 m-85 -100.47 156.93 17.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.917 0.389 . . . . 0.0 110.628 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.96 95.21 8.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.935 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 51.5 p -80.14 155.01 27.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.174 0.512 . . . . 0.0 110.88 -178.801 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -155.55 139.34 8.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 -178.47 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.3 t -117.13 116.04 50.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.505 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.875 0.369 . . . . 0.0 110.436 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 m-85 . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.605 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.22 148.97 29.19 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 111.266 -179.749 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.431 HG23 ' HB3' ' A' ' 26' ' ' LEU . 58.9 t -121.62 99.41 7.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.579 179.666 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HG2' ' N ' ' A' ' 50' ' ' ILE . 2.4 tt0 -104.02 142.25 34.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.907 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.39 123.25 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.623 0.725 . . . . 0.0 111.281 179.423 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.429 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.13 101.62 0.23 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.768 -1.106 . . . . 0.0 112.888 179.726 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.99 116.42 22.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.664 0.269 . . . . 0.0 110.399 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.29 171.09 14.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.084 0.469 . . . . 0.0 111.637 -179.209 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.4 p -80.43 -17.86 50.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.956 179.556 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -113.41 131.75 55.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.947 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 14.7 ttpt -57.64 -39.35 76.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.488 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -45.88 -32.1 2.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.02 0.438 . . . . 0.0 110.927 -179.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.446 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 73.2 m-80 -72.15 -49.41 36.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.308 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.49 -43.86 84.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.066 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.11 -49.81 76.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.872 0.368 . . . . 0.0 110.933 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.442 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.8 m -59.46 -36.06 75.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.0 -52.74 21.71 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 121.792 0.806 . . . . 0.0 110.282 179.479 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.48 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -53.98 -58.22 8.12 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.982 -177.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.89 -37.0 60.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.348 179.361 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.74 -39.79 94.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.715 179.016 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.456 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.69 -40.93 96.23 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.572 179.009 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.3 OUTLIER -62.13 -46.99 86.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.562 178.834 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -69.44 -25.57 64.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.791 178.618 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.82 -22.6 53.37 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.459 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 23.49 5.66 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 -179.325 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.66 148.4 52.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.386 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.6 t70 -91.98 74.65 5.59 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.465 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -85.79 140.39 30.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.085 0.469 . . . . 0.0 111.88 179.962 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.4 pt -132.66 151.97 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.925 179.098 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.3 t -102.61 137.14 31.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.893 0.378 . . . . 0.0 111.114 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.962 -179.877 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 tp . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.764 0.316 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 mttt 59.84 104.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.0 155.26 29.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.823 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.0 m 62.73 119.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.847 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.0 p -71.57 134.62 46.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.84 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.8 m -106.32 115.78 30.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.979 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -166.14 91.62 0.47 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.62 156.69 27.44 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.545 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.2 mt -143.61 139.82 29.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.1 m-85 -101.79 105.91 16.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.069 0.461 . . . . 0.0 110.186 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -125.21 151.91 45.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.332 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.515 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -103.85 142.62 17.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.184 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -136.33 131.94 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.863 0.363 . . . . 0.0 111.342 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.468 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.36 -5.46 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.69 173.54 28.3 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 119.236 -1.459 . . . . 0.0 114.43 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.41 142.74 23.38 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -147.75 150.62 34.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.038 0.447 . . . . 0.0 111.405 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 8.0 ttmt -60.54 -15.07 23.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.415 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.4 t -106.54 129.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 121.112 0.482 . . . . 0.0 111.785 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.456 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.2 ttpt -71.88 -39.17 69.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.512 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.72 -32.0 66.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.132 0.491 . . . . 0.0 109.827 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -77.51 -34.43 54.04 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.259 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -19.49 60.98 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.839 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.67 -38.34 21.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -38.03 88.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.459 ' CG ' HG13 ' A' ' 14' ' ' ILE . 50.5 tp -65.95 -50.06 65.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.217 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.54 -24.32 60.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.485 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.85 -41.5 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.612 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -58.68 -47.38 84.68 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.513 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.448 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -61.51 -40.29 94.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.522 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.71 -37.31 65.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.304 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.32 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.36 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -62.5 -28.48 69.87 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.66 32.92 3.0 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.54 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.487 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.3 m-85 -100.35 155.88 17.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -85.02 94.51 8.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.8 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.6 p -80.17 156.0 27.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.175 0.512 . . . . 0.0 111.017 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.66 137.71 7.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.913 -178.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 47.5 t -114.98 113.86 44.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.028 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.87 125.27 54.18 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.006 0.431 . . . . 0.0 110.499 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.513 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tp -88.07 114.04 24.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.319 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.632 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -98.7 166.82 11.14 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.471 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 12.4 t70 -55.18 66.94 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.6 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.98 -23.93 3.48 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 120.135 -1.031 . . . . 0.0 115.036 178.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.632 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 20.1 mt -143.4 166.21 25.4 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.163 0.982 . . . . 0.0 112.744 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.513 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 27.9 m-85 -112.97 134.18 54.6 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.454 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.88 148.24 29.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.129 0.49 . . . . 0.0 111.815 -179.243 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.4 HG11 HD12 ' A' ' 14' ' ' ILE . 90.2 t -120.77 101.62 10.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.787 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HG2' ' N ' ' A' ' 50' ' ' ILE . 1.9 tt0 -107.5 142.19 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.864 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.505 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.13 123.07 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.518 0.675 . . . . 0.0 111.449 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.427 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.11 105.57 0.22 Allowed Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.865 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.1 124.87 40.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.647 0.261 . . . . 0.0 110.505 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.69 172.99 11.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.136 0.493 . . . . 0.0 111.499 -179.344 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -83.04 -15.92 49.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.997 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 128.52 56.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.898 0.38 . . . . 0.0 111.028 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -56.32 -34.92 67.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.212 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.48 -30.88 32.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.442 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 63.9 m-80 -70.8 -50.24 37.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.681 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.405 ' HB3' ' CG1' ' A' ' 75' ' ' VAL . . . -59.75 -40.2 87.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.926 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -60.47 -51.47 69.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -59.02 -35.98 74.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.486 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.63 -52.04 29.52 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.846 0.831 . . . . 0.0 110.131 179.518 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.515 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -53.69 -59.05 5.11 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.993 -177.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.6 -36.75 56.9 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.522 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.5 ttt180 -64.33 -38.72 92.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.766 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.462 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.94 -40.88 95.71 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.543 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.9 mttm -61.86 -46.88 87.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.678 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.52 -25.69 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.817 178.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.458 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.08 -22.54 52.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.4 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.1 23.93 5.34 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.583 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.41 148.46 52.66 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.6 t70 -92.33 74.32 5.3 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.579 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -84.33 142.9 29.85 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-O 121.234 0.54 . . . . 0.0 111.845 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.419 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.51 152.74 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.016 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.405 ' CG1' ' HB3' ' A' ' 59' ' ' ALA . 90.8 t -104.91 134.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.902 0.382 . . . . 0.0 110.848 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.5 tt -135.68 139.24 46.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.286 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.428 HD12 ' CE1' ' A' ' 10' ' ' TYR . 14.2 tp -96.74 104.44 16.44 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.139 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -104.7 129.06 52.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.842 0.353 . . . . 0.0 111.305 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.904 179.906 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.859 0.361 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.79 170.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.969 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -123.02 176.7 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.859 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.3 p -110.02 142.8 40.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -106.19 31.03 5.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.49 -66.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 m -78.34 132.64 37.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -77.78 -165.62 26.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.508 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.9 mt -143.84 140.31 29.76 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.9 m-85 -101.7 105.74 16.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.127 0.489 . . . . 0.0 110.241 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -125.4 157.3 37.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.1 OUTLIER -110.57 136.24 47.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.356 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.096 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.5 135.32 47.83 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 111.453 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.493 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.32 -6.16 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.47 177.0 29.21 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 119.176 -1.488 . . . . 0.0 114.595 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.65 144.05 24.12 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -147.86 149.65 32.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.382 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.37 -14.31 26.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.47 179.638 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 125.28 62.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.041 0.448 . . . . 0.0 111.985 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.2 tmtt? -67.11 -41.01 86.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.492 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.65 66.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.118 0.485 . . . . 0.0 109.906 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -77.93 -35.46 50.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.391 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.98 -19.08 61.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.802 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.53 -37.51 21.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.639 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -37.33 86.14 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.472 ' CG ' HG13 ' A' ' 14' ' ' ILE . 55.5 tp -66.82 -51.01 60.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.999 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 37' ' ' SER . . . -58.15 -24.62 59.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.599 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -72.53 -41.41 65.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.519 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.47 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -58.89 -47.71 84.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.588 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.47 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.87 -40.91 94.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.597 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -55.22 -37.14 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.382 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.91 -50.85 65.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.235 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.7 mmtt -62.45 -28.53 69.87 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.5 31.52 3.21 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.519 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.6 m-85 -100.49 157.26 16.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 0.0 110.794 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -86.81 93.98 9.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.758 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.405 ' HB2' ' CB ' ' A' ' 27' ' ' ALA . 99.2 p -80.29 157.78 26.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.138 0.494 . . . . 0.0 110.918 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -156.27 138.51 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.01 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.1 t -117.41 116.71 52.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.023 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.06 125.14 54.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.0 110.692 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.486 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.9 tp -86.49 114.16 23.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.195 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.643 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.6 167.02 10.61 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.492 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.1 m-20 -54.93 65.16 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.619 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.4 -23.24 3.65 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.116 -1.04 . . . . 0.0 115.035 178.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.643 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 22.9 mt -142.43 163.57 32.47 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.263 1.032 . . . . 0.0 113.035 -178.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.486 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 27.8 m-85 -111.95 132.16 54.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.53 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.585 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -103.88 146.55 28.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.126 0.489 . . . . 0.0 111.722 -179.45 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.442 HG13 HD13 ' A' ' 14' ' ' ILE . 99.4 t -120.99 102.59 12.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.678 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.404 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 36.3 tt0 -111.38 143.76 41.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.274 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.462 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.38 123.82 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.525 0.679 . . . . 0.0 111.454 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.53 109.78 0.29 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.04 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -132.85 122.38 24.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.747 0.308 . . . . 0.0 110.259 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.66 175.44 9.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.071 0.462 . . . . 0.0 111.621 -179.248 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.65 -15.38 39.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.124 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.7 t -112.07 126.94 55.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -55.63 -36.28 66.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.178 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -53.04 -30.05 33.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.904 0.383 . . . . 0.0 110.99 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.451 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 2.7 m-80 -72.84 -49.37 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.741 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.81 -40.96 94.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.003 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -60.38 -49.99 75.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.824 0.345 . . . . 0.0 110.83 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.7 m -58.01 -37.77 74.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.783 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.503 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.8 -50.42 50.42 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.782 0.801 . . . . 0.0 110.177 179.297 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.43 ' CB ' HG13 ' A' ' 12' ' ' VAL . . . -53.2 -60.81 2.82 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.306 -1.315 . . . . 0.0 111.098 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.7 54.28 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.691 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -65.46 -38.02 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.75 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.504 ' CB ' ' HB2' ' A' ' 73' ' ' ALA . . . -65.67 -41.71 92.15 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.714 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.3 mttm -62.04 -46.37 89.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.597 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.28 -25.73 63.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.737 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.467 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.23 -23.83 54.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.8 24.51 4.9 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.546 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.68 149.03 52.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 16.3 t70 -93.26 72.51 4.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.83 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.504 ' HB2' ' CB ' ' A' ' 66' ' ' ALA . . . -87.61 144.75 26.52 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.07 0.462 . . . . 0.0 111.69 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.488 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.0 pp -133.43 157.67 42.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.756 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 84.0 t -109.84 134.68 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.976 0.417 . . . . 0.0 111.029 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 pt -134.3 142.22 41.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.364 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.448 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.5 tp -104.41 104.29 14.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.33 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -133.8 143.73 48.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.909 0.385 . . . . 0.0 111.002 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.834 -179.991 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.825 0.345 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.4 mttm 60.55 175.56 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -100.18 172.94 6.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.25 31.49 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.903 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.05 -47.54 4.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.58 122.16 0.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.032 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 m -139.14 157.76 45.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.661 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.401 ' CA ' HD13 ' A' ' 77' ' ' LEU . . . -175.96 -119.08 0.55 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.815 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.9 mp -144.19 142.94 30.83 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.514 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.2 m-85 -101.92 106.61 17.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.077 0.465 . . . . 0.0 110.05 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.0 mttt -126.45 155.36 42.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.644 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.47 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -108.27 137.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.395 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -129.96 135.82 48.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.572 0.225 . . . . 0.0 110.996 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -109.22 -6.35 11.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -179.124 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.91 174.34 28.49 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 119.047 -1.549 . . . . 0.0 114.781 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.8 143.33 23.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -145.89 149.15 33.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 111.323 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 4.7 ptpp? -61.7 -13.56 23.93 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.345 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.43 126.44 63.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.061 0.458 . . . . 0.0 111.94 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 5.5 tmtt? -65.87 -42.19 90.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.591 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.54 -33.13 65.8 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.166 0.508 . . . . 0.0 109.895 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -77.16 -36.21 55.37 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.44 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.84 62.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.666 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -35.73 26.88 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 t -64.87 -36.69 85.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.53 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.48 -50.98 48.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.383 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.89 -25.25 56.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.067 0.46 . . . . 0.0 110.592 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -41.37 60.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.761 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.53 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.04 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.845 0.355 . . . . 0.0 110.401 179.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.517 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -59.71 -40.35 87.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.308 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -55.37 -36.45 66.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.88 -51.74 54.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.354 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -62.83 -28.49 70.05 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.5 34.25 2.92 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.502 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.491 ' CD2' HD11 ' A' ' 62' ' ' LEU . 7.6 m-85 -100.84 156.12 17.55 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.126 0.488 . . . . 0.0 110.92 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.33 89.92 7.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.529 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.1 m -80.33 158.68 26.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 110.526 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -156.87 141.64 8.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.17 -178.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 58.8 t -117.81 116.5 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.005 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.51 124.89 53.47 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.813 0.339 . . . . 0.0 110.658 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.9 tp -87.36 115.88 25.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.314 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.661 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -102.84 166.8 10.26 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.089 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 46.2 m-20 -54.8 65.4 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.621 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 133.1 -22.18 4.04 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.234 -0.984 . . . . 0.0 115.186 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.661 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 28.3 mt -141.89 160.15 40.78 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.248 1.024 . . . . 0.0 113.006 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.507 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 25.0 m-85 -111.23 130.26 55.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.492 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -105.06 147.92 27.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.175 0.512 . . . . 0.0 111.744 -179.307 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.423 HG11 HD11 ' A' ' 14' ' ' ILE . 60.5 t -123.08 103.41 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -108.97 143.18 38.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.123 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.473 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.9 pp -135.27 123.89 40.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.519 0.676 . . . . 0.0 111.574 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.73 104.98 0.25 Allowed Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.913 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.01 112.78 14.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.709 0.29 . . . . 0.0 110.339 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.9 171.13 14.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 0.0 111.467 -179.302 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -81.42 -16.44 52.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.007 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.34 131.47 56.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.869 0.366 . . . . 0.0 111.07 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.0 ttpt -58.14 -37.76 75.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.314 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -46.32 -32.54 3.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.094 0.473 . . . . 0.0 110.825 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.435 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 10.4 m120 -73.46 -48.83 30.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.28 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.79 -45.53 89.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.163 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.83 -51.1 71.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 71.5 m -59.19 -35.67 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.884 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.491 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.51 -51.92 31.33 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 121.815 0.817 . . . . 0.0 110.129 179.488 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.47 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.6 -59.69 4.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.021 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.06 46.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.387 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt-85 -65.33 -39.9 93.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.88 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.463 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.18 -40.97 97.21 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.703 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 40.6 mttm -62.34 -46.85 86.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.664 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.53 -25.44 64.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.794 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -76.81 -22.49 53.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.368 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.19 23.92 5.61 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.73 149.0 52.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.255 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 31.2 t0 -92.25 74.23 5.37 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.821 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.463 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.67 140.51 30.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.088 0.471 . . . . 0.0 111.842 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pt -132.66 149.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.085 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 91.7 t -102.78 135.8 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 0.0 110.969 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 pt -138.87 139.98 39.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.432 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 17.5 tp -93.3 105.32 17.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.142 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -95.84 117.95 31.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.182 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.896 179.797 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.822 0.344 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.71 149.8 41.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -133.46 -48.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.3 p -80.19 114.41 19.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.943 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.6 p -174.42 174.47 2.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.919 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.84 -171.29 1.83 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 27.6 m -154.95 88.35 1.18 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 160.0 -155.08 26.17 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.7 mt -144.02 140.28 29.48 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.1 m-85 -101.4 106.45 17.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.312 -0.403 . . . . 0.0 109.987 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttm -126.03 155.7 41.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.494 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -107.25 142.77 19.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.211 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.301 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -135.15 132.83 38.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 111.166 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.469 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.09 -5.39 10.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.83 174.1 28.09 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 119.209 -1.472 . . . . 0.0 114.562 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.76 143.85 23.9 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.364 178.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -147.37 151.45 36.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.374 . . . . 0.0 111.286 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.422 ' CG ' ' CD2' ' A' ' 45' ' ' LEU . 10.3 mttt -61.14 -15.57 34.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.385 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.4 t -105.8 128.4 60.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 121.032 0.444 . . . . 0.0 112.073 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.4 tmtt? -68.62 -42.59 77.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.481 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.44 -31.29 61.78 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.128 0.489 . . . . 0.0 109.95 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -77.94 -35.2 50.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.464 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.67 -21.19 61.84 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.12 -37.55 23.62 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.441 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -65.15 -36.11 83.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.23 0.538 . . . . 0.0 109.612 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.544 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 31.5 tp -69.07 -48.2 63.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.286 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.16 -25.93 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.064 0.459 . . . . 0.0 110.426 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.2 t -75.1 -40.63 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.544 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.36 -48.25 82.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.921 0.391 . . . . 0.0 110.709 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.516 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.92 -38.38 90.73 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.352 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.76 -36.41 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.323 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -50.99 64.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.513 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 9.6 mmpt? -62.2 -28.01 69.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.37 32.39 3.22 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.421 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.481 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.4 m-85 -99.64 154.76 18.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.01 0.433 . . . . 0.0 110.751 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.39 92.58 7.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.751 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.0 p -79.95 156.06 27.41 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.036 0.446 . . . . 0.0 110.967 -178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.65 141.47 7.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.772 -178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.591 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.4 t -120.02 119.13 59.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.295 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.27 125.76 53.69 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 110.394 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.514 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.2 tp -87.38 115.06 24.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.307 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.672 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.14 166.63 10.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.892 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.4 m-20 -55.35 65.96 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.46 -22.15 3.75 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 120.192 -1.004 . . . . 0.0 115.115 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.672 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 25.4 mt -142.67 161.6 37.64 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.189 0.994 . . . . 0.0 112.704 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.514 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 27.7 m-85 -111.1 131.95 54.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.273 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.591 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.7 149.3 27.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 111.79 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.424 HG21 ' HB3' ' A' ' 26' ' ' LEU . 61.8 t -123.0 104.36 14.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.683 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -109.39 142.75 39.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.117 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.47 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.04 123.66 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-O 121.551 0.691 . . . . 0.0 111.592 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.91 103.91 0.26 Allowed Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.991 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.31 122.69 37.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.85 172.02 13.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.485 . . . . 0.0 111.567 -179.042 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.41 -16.97 47.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.005 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.12 130.8 56.57 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.827 0.346 . . . . 0.0 111.095 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.6 ttpt -57.95 -38.03 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.359 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -46.46 -31.31 2.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.967 0.413 . . . . 0.0 110.775 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.445 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 3.7 m-80 -74.07 -48.69 28.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.379 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.13 -44.63 94.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.155 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -59.07 -52.01 67.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.125 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 14.9 t -59.49 -34.15 72.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.925 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.475 HD13 ' CG ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.03 -51.88 28.58 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.701 0.763 . . . . 0.0 109.932 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.494 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.09 -58.11 8.57 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.878 -177.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.43 -35.96 61.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt180 -64.91 -39.48 93.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.682 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.46 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.91 -40.75 95.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.584 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.577 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 26.3 mttm -61.98 -47.34 85.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.706 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.78 -25.92 64.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.83 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.446 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -76.98 -21.9 54.0 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.388 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.92 23.91 5.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.484 -179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.577 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.01 148.89 52.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 28.1 t70 -92.37 74.58 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.926 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.13 142.0 29.81 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.104 0.478 . . . . 0.0 111.868 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.3 pt -133.77 151.47 33.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.881 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 94.7 t -104.68 134.6 45.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.978 0.418 . . . . 0.0 111.05 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.411 HG21 HD13 ' A' ' 76' ' ' ILE . 0.0 OUTLIER -135.45 138.04 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.019 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 10' ' ' TYR . 15.2 tp -93.25 107.4 19.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.238 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -89.08 103.88 16.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.004 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.905 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 tp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.953 0.406 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -142.18 -178.02 5.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.872 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 tttt -165.7 37.92 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.74 95.32 5.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.913 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.1 p -100.25 131.23 46.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.9 t -128.84 142.51 50.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.53 149.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.55 167.21 13.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.48 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 39.0 mt -143.49 138.57 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.511 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.3 m-85 -102.0 105.64 16.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.011 0.434 . . . . 0.0 110.109 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -124.99 156.36 38.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.437 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -110.5 138.14 39.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.318 179.865 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -132.22 136.48 47.03 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.888 0.375 . . . . 0.0 111.167 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.525 HG13 HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -109.02 -5.39 10.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -179.085 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.38 173.45 28.95 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 118.942 -1.599 . . . . 0.0 114.93 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.416 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.4 142.7 23.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.958 -0.621 . . . . 0.0 109.472 178.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.16 149.23 33.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.878 0.37 . . . . 0.0 111.254 -179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 2.9 ttpt -60.81 -15.31 28.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.419 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.83 130.27 60.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.637 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -69.43 -40.15 77.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.633 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -35.54 66.11 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.286 0.565 . . . . 0.0 109.619 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -73.99 -34.2 64.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.209 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.45 -19.74 61.51 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -35.49 25.58 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.474 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 t -67.68 -38.92 84.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 0.0 109.724 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.525 HD11 HG13 ' A' ' 14' ' ' ILE . 20.4 tp -65.84 -53.29 41.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.379 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.35 -24.52 63.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -70.85 -42.39 70.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.537 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.502 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.89 -46.25 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.518 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.49 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.668 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.43 -37.18 67.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.149 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.94 -49.99 67.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.268 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.83 -29.04 70.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.423 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.14 32.92 2.89 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.539 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CD2' HD11 ' A' ' 62' ' ' LEU . 6.9 m-85 -101.47 158.36 16.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.053 0.454 . . . . 0.0 110.544 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -87.27 94.86 9.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.634 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.0 p -80.07 157.38 26.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.845 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.91 137.43 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.752 -178.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.7 t -114.22 112.83 41.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.199 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.404 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -109.16 122.98 48.47 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.013 0.435 . . . . 0.0 110.921 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.498 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tp -87.85 115.0 25.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.679 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -101.44 166.45 10.72 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.499 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 6.5 t0 -55.08 65.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.617 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.01 -23.29 3.73 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 120.207 -0.997 . . . . 0.0 115.071 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.679 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 25.8 mt -141.21 161.77 37.07 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.277 1.038 . . . . 0.0 112.839 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.498 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 25.1 m-85 -112.66 134.31 54.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.671 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.38 148.84 28.57 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.156 0.503 . . . . 0.0 111.993 -179.558 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.432 HG12 ' HG ' ' A' ' 26' ' ' LEU . 42.9 t -121.89 99.01 6.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.307 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -106.42 143.04 35.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.075 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.49 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.75 123.35 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 111.513 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.76 110.12 0.3 Allowed Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 114.763 -1.108 . . . . 0.0 113.053 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -134.66 112.91 11.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.744 0.307 . . . . 0.0 110.52 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.5 174.53 10.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.039 0.447 . . . . 0.0 111.57 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -84.73 -16.24 42.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.19 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.68 128.3 56.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.9 0.381 . . . . 0.0 111.044 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.511 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.0 -36.86 65.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.228 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -53.01 -30.23 34.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.439 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -72.18 -49.21 37.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.803 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.2 97.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.002 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.61 -50.99 71.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.971 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.2 m -57.12 -37.64 72.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.811 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.506 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.67 -50.1 53.82 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.737 0.78 . . . . 0.0 110.279 179.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.435 ' CB ' HG13 ' A' ' 12' ' ' VAL . . . -53.93 -60.64 3.06 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.166 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.74 59.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -63.88 -40.11 95.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.068 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.476 ' CB ' ' HB3' ' A' ' 73' ' ' ALA . . . -64.43 -40.5 95.87 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.69 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 33.3 mttm -62.03 -46.77 87.74 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -69.32 -26.37 64.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.826 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.445 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.44 54.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.411 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.73 24.19 5.35 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.571 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.74 148.91 52.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.427 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 36.4 t70 -92.63 72.71 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.6 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.482 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -85.16 141.87 29.88 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.149 0.499 . . . . 0.0 111.745 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 7.6 pt -133.11 154.75 40.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.925 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.1 t -108.48 135.82 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.953 0.406 . . . . 0.0 110.881 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 pt -137.61 141.27 39.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.562 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.436 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 13.4 tp -101.06 102.98 14.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.172 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -105.37 138.45 41.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.846 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -116.05 124.29 50.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.26 84.84 6.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.0 p -76.82 156.93 31.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.19 99.38 1.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.942 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.02 79.38 1.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.4 171.88 19.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -139.45 -117.69 1.49 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.509 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 1.4 mt -143.68 138.36 28.86 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.9 m-85 -101.96 105.84 16.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.044 0.449 . . . . 0.0 110.214 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -125.83 153.01 44.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.448 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.509 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.7 136.37 41.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.372 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.358 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.19 135.38 48.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.598 0.237 . . . . 0.0 111.021 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.45 -6.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.789 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.41 172.09 29.4 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 118.834 -1.65 . . . . 0.0 114.885 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.515 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.92 138.1 19.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.849 -0.675 . . . . 0.0 109.486 178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 46' ' ' TYR . 1.6 m-85 -148.72 150.76 33.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 111.079 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 32.9 tttt -61.21 -12.65 13.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.068 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -109.13 129.9 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 111.907 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.7 -38.35 67.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.592 179.811 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.8 -34.86 63.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.328 0.585 . . . . 0.0 109.634 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -75.4 -31.87 60.56 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.178 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.36 -18.86 60.62 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.93 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -84.71 -38.18 20.04 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.634 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -68.43 -35.73 78.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 109.588 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' CG ' HG13 ' A' ' 14' ' ' ILE . 56.7 tp -68.14 -51.99 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.119 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.97 -24.43 62.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.408 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.7 m -71.32 -41.27 70.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.5 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.465 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -59.64 -46.93 87.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.446 179.568 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.465 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -59.67 -41.45 90.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.556 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -55.63 -36.83 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.233 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.38 -51.19 63.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.393 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.6 mmpt? -62.73 -28.54 70.03 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.91 32.8 2.98 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.513 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.1 m-85 -101.16 157.62 16.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 110.809 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.41 92.23 8.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 77.3 p -80.35 156.66 26.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.142 0.496 . . . . 0.0 111.033 -178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.89 141.86 5.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.527 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 23.0 t -114.65 111.68 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.175 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.519 ' O ' ' HD3' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -107.29 124.78 50.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.918 0.39 . . . . 0.0 110.511 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.48 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.1 tp -87.11 112.37 21.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.043 0.449 . . . . 0.0 110.914 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.662 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -91.67 166.11 12.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.326 178.369 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.479 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.9 OUTLIER -57.43 68.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.815 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.94 -24.42 3.45 Favored Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.286 -0.959 . . . . 0.0 114.507 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.662 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 21.2 mt -143.47 170.83 15.06 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 117.799 0.8 . . . . 0.0 112.32 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.48 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 24.6 m-85 -115.68 139.58 50.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.303 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -122.23 158.89 28.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.99 114.08 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.296 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 12' ' ' VAL . 23.2 tt0 -112.45 137.52 50.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.797 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.455 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.54 123.97 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.625 0.726 . . . . 0.0 111.488 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.403 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 78.55 102.35 0.21 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.085 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.11 120.99 31.6 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -141.04 174.32 10.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.153 0.501 . . . . 0.0 111.589 -179.065 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.1 m -84.72 -15.76 44.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.001 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -112.42 128.08 56.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.79 0.329 . . . . 0.0 111.098 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -56.6 -35.18 67.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.27 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -51.86 -31.5 28.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.85 0.357 . . . . 0.0 110.98 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.436 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 9.9 m-80 -71.98 -49.74 34.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.577 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.95 -42.24 93.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.17 -50.93 71.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.819 0.342 . . . . 0.0 110.793 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.8 m -58.54 -37.12 75.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.824 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.515 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.52 -51.27 44.86 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.752 0.787 . . . . 0.0 110.154 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.509 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.39 -59.97 3.97 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.091 -177.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.31 -36.62 43.51 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -65.69 -39.53 91.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.836 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.471 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.0 -41.88 94.97 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.562 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.0 mmmm -61.79 -46.8 87.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.795 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -69.85 -25.55 63.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.747 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.449 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.38 -22.43 54.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.381 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.94 23.39 5.59 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.446 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.39 147.6 52.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.458 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 33.8 t70 -91.02 73.36 6.41 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.675 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.472 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -85.6 140.55 30.5 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.105 0.478 . . . . 0.0 111.871 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.433 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 pt -132.53 151.15 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.833 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.4 t -103.95 135.72 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.858 0.361 . . . . 0.0 110.982 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.0 pt -136.36 139.57 45.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.249 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.448 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.6 tp -96.09 106.62 18.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.325 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -93.97 109.04 20.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.873 0.368 . . . . 0.0 111.032 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.959 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.794 0.331 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.88 117.45 14.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.822 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -114.85 -40.69 3.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.961 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 t -130.78 147.42 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.61 76.36 0.38 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 73.1 m -88.94 -176.41 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.957 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 m 62.3 39.26 12.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.84 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -103.88 -131.06 7.09 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.333 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.4 mp -143.95 139.29 29.03 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.515 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.5 m-85 -101.94 105.72 16.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.035 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.49 152.98 44.24 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.507 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.35 137.72 35.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.131 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -132.96 134.47 44.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.698 0.285 . . . . 0.0 111.253 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.473 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.86 -4.79 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.96 174.7 29.01 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 119.135 -1.507 . . . . 0.0 114.766 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.401 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.19 141.78 22.63 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -147.87 149.8 32.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.025 0.441 . . . . 0.0 111.351 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 8.1 tttt -61.58 -13.74 24.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -106.58 126.18 62.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.794 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.12 -40.57 82.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.469 179.58 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.49 -32.27 64.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.263 0.554 . . . . 0.0 109.9 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -77.54 -34.01 54.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.395 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.92 -19.54 60.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.849 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.43 -37.49 21.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.562 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -38.63 88.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.297 0.57 . . . . 0.0 109.63 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.458 ' CG ' HG13 ' A' ' 14' ' ' ILE . 40.5 tp -66.09 -51.48 57.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.188 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.19 -23.93 57.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.543 179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.1 m -73.0 -41.32 64.42 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.677 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.459 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.27 -47.16 86.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.604 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.462 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -61.68 -40.61 95.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.578 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -55.14 -37.24 66.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.283 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.76 -49.93 69.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.27 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.51 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -62.39 -28.49 69.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.93 31.43 3.36 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.555 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.0 m-85 -100.1 156.07 17.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.92 0.39 . . . . 0.0 110.799 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.88 93.13 8.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.696 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.0 p -80.28 157.22 26.49 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 121.128 0.489 . . . . 0.0 110.926 -178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -156.95 139.66 6.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.705 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.58 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.5 t -116.41 115.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.219 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.408 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -110.41 124.29 51.46 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.812 179.815 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 42' ' ' LYS . 5.0 tp -88.74 114.73 25.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.176 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.65 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.45 166.92 10.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.146 178.236 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.492 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 14.1 t0 -53.72 65.3 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.64 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.19 -23.07 3.71 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 120.218 -0.991 . . . . 0.0 115.295 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.65 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 25.0 mt -141.98 163.51 32.69 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.34 1.07 . . . . 0.0 113.0 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.482 ' CE1' HD11 ' A' ' 41' ' ' LEU . 29.6 m-85 -112.22 134.44 53.76 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.648 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.58 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.55 148.65 28.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.179 0.514 . . . . 0.0 111.84 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.468 HG12 HD12 ' A' ' 14' ' ' ILE . 88.8 t -120.54 100.41 9.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.393 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -108.97 142.39 39.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.319 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.462 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -136.31 122.98 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.538 0.685 . . . . 0.0 111.657 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.16 107.67 0.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.912 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.12 118.59 21.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.651 0.262 . . . . 0.0 110.428 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -138.31 172.79 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 111.48 -179.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -84.15 -15.49 46.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.092 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.29 128.81 56.38 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.0 tmtm? -55.65 -35.58 66.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.275 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -53.17 -29.96 34.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.455 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 26.4 m120 -71.56 -49.85 36.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.721 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.99 -40.87 95.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.061 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.2 -50.96 71.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.741 0.305 . . . . 0.0 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 13.6 m -58.59 -37.46 75.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.58 -51.03 47.03 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.732 0.777 . . . . 0.0 110.085 179.449 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.507 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.36 -59.99 3.95 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.093 -177.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.84 -36.05 46.77 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.43 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.98 -38.74 89.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.871 178.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.463 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.67 -41.14 96.28 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.662 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -62.27 -46.25 89.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.722 178.776 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -25.54 63.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.694 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.465 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.45 -23.64 53.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.35 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.9 23.38 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.552 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.552 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.67 148.26 52.44 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 45.6 t0 -91.79 74.03 5.75 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.644 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -84.07 142.29 30.52 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.066 0.46 . . . . 0.0 111.956 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.4 pt -133.12 151.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.8 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 96.5 t -105.42 135.41 43.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.393 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 30.1 pt -135.51 138.95 47.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.221 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.442 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.1 tp -100.61 104.64 15.98 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.292 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -94.27 113.58 25.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.03 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.859 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.802 0.334 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -67.19 -35.78 80.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.991 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -138.26 70.64 1.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.966 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.05 174.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.898 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.4 t -108.8 137.13 47.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.986 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.29 99.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.6 t -92.98 -57.6 2.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.803 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.18 110.86 0.51 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.57 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 3.4 mm? -141.68 137.86 32.05 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -100.93 106.77 18.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.195 0.522 . . . . 0.0 110.17 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -125.85 152.97 44.79 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.403 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.501 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.18 140.57 22.81 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.209 179.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.4 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 42.2 tt0 -132.92 131.81 41.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.717 0.294 . . . . 0.0 111.281 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.479 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.02 -5.57 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -179.284 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.19 172.28 28.31 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 119.104 -1.522 . . . . 0.0 114.634 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.404 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 141.07 22.09 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 114.884 -0.658 . . . . 0.0 109.254 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -146.63 150.28 35.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.913 0.387 . . . . 0.0 111.357 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.37 -13.81 22.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.424 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.45 128.5 60.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.046 0.451 . . . . 0.0 111.989 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 7.2 tmtt? -69.34 -41.13 77.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.487 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.74 -31.06 64.18 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.171 0.51 . . . . 0.0 109.924 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -78.07 -35.1 49.9 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.335 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.32 -22.99 61.85 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.772 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -38.66 26.85 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.531 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -63.67 -37.73 88.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.228 0.537 . . . . 0.0 109.653 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 27.2 tp -67.31 -46.03 74.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.198 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.39 -26.59 65.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.462 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -41.05 60.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.21 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.542 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.1 -48.07 82.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.695 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.515 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -63.2 -38.2 90.22 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.348 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -54.85 -36.65 65.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.462 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.01 -51.55 56.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.557 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 7.5 mmtm -62.64 -28.13 69.7 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.78 34.47 2.81 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.461 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.491 ' CD2' HD13 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.61 155.41 17.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.975 0.416 . . . . 0.0 110.85 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -83.46 94.34 7.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.824 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 80.1 p -79.96 155.2 27.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.971 -178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -155.9 139.95 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.699 -178.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.621 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -118.59 116.25 50.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.391 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.405 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.2 OUTLIER -110.62 124.12 51.28 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 110.724 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.518 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.4 tp -88.34 114.83 25.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.228 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.667 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -99.96 166.63 10.96 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 177.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.496 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.9 OUTLIER -55.71 66.67 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 133.82 -22.92 3.8 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.02 -1.086 . . . . 0.0 115.004 178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.667 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 29.3 mt -141.72 161.78 37.09 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.193 0.996 . . . . 0.0 112.91 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.518 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 26.7 m-85 -112.78 134.4 54.32 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.622 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.621 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.14 150.59 27.02 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 111.541 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.423 HG21 ' HB3' ' A' ' 26' ' ' LEU . 98.3 t -124.36 102.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.633 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HG2' ' N ' ' A' ' 50' ' ' ILE . 2.6 tt0 -106.84 142.86 35.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.047 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.483 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.8 pp -134.62 123.16 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.472 0.654 . . . . 0.0 111.488 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.414 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.22 105.52 0.23 Allowed Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.894 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.88 122.38 32.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.659 0.266 . . . . 0.0 110.397 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -140.74 171.62 13.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.203 0.525 . . . . 0.0 111.454 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -17.25 51.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.866 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.0 t -113.78 130.27 56.47 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.865 0.365 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 13.3 ttpt -57.13 -37.47 72.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.398 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.11 -31.16 3.25 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.966 0.412 . . . . 0.0 110.698 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CD1' ' A' ' 53' ' ' PHE . 19.8 m120 -73.28 -49.99 24.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.235 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.73 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.12 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.24 -51.15 71.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.844 0.355 . . . . 0.0 111.009 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 28.3 m -58.84 -35.21 72.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.491 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.33 -51.95 26.33 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.747 0.785 . . . . 0.0 110.187 179.435 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.501 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.99 -57.9 9.29 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.231 -1.35 . . . . 0.0 111.013 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.36 -37.39 62.35 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.429 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -64.47 -38.23 90.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.639 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.452 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.27 -41.15 94.49 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.624 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.8 mttm -62.17 -46.94 86.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.691 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.29 -25.44 64.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.686 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.432 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.16 -22.54 52.37 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.36 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 23.59 5.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.584 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.566 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.36 148.93 52.72 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.5 74.74 5.16 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.807 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.479 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -85.47 141.83 29.65 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.062 0.458 . . . . 0.0 111.95 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.432 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pp -133.27 152.11 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.02 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.9 t -104.78 136.35 38.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.798 0.333 . . . . 0.0 111.085 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.3 141.84 32.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.354 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.5 tp -90.58 110.76 21.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.196 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -93.22 143.08 26.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.023 0.44 . . . . 0.0 111.172 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.158 0 CA-C-O 118.108 -0.948 . . . . 0.0 110.832 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.883 0.373 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.9 -52.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 138.87 31.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.887 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.48 176.1 8.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.91 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.5 m -141.14 -49.18 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.958 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.7 m -127.74 162.53 26.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.902 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 m -83.9 163.19 20.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.928 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.39 153.65 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.509 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.2 mp -143.97 140.14 29.48 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.513 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.6 m-85 -101.43 106.62 17.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.037 0.446 . . . . 0.0 109.997 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.49 155.45 38.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.429 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.526 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -106.78 142.92 18.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.284 179.876 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -133.91 132.74 40.62 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.469 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.07 -5.97 9.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.76 173.79 29.8 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 118.877 -1.63 . . . . 0.0 114.893 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.476 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.01 135.91 17.36 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.962 -0.619 . . . . 0.0 109.71 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 46' ' ' TYR . 2.0 m-85 -145.01 149.37 35.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.8 0.334 . . . . 0.0 111.08 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 4.7 ttpm? -60.78 -14.13 19.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.937 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -106.76 127.99 61.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.062 0.458 . . . . 0.0 112.107 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -69.64 -42.27 74.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.579 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.11 -32.52 47.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.177 0.513 . . . . 0.0 109.815 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -76.94 -32.58 57.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.282 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.09 -20.63 60.2 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.891 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -39.13 20.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 110.747 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 t -66.61 -37.13 84.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 0.0 109.659 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.468 ' CG ' HG13 ' A' ' 14' ' ' ILE . 55.8 tp -66.47 -52.1 49.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.182 179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.03 -24.45 58.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.1 t -71.83 -41.74 67.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.556 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -58.88 -47.55 84.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.571 179.599 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.466 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -60.09 -41.41 92.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.648 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.15 -37.02 66.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.234 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.8 -51.12 64.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.341 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.456 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.43 -28.43 69.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.73 31.69 3.11 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.687 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -101.01 158.0 16.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 94.9 9.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.751 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.5 p -80.29 156.83 26.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.227 0.537 . . . . 0.0 110.982 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.97 137.13 5.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.659 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.452 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.3 t -113.98 112.67 41.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.437 ' O ' ' HD3' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -108.09 124.24 49.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.934 0.397 . . . . 0.0 110.614 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.475 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.1 tp -84.99 110.48 18.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.084 0.469 . . . . 0.0 111.211 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.599 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -92.1 166.48 12.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.471 178.675 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.571 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.9 m-20 -57.24 66.08 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 126.29 -12.02 7.16 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.429 -0.891 . . . . 0.0 114.4 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.599 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 33.5 mt -144.6 158.18 43.88 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 117.543 0.672 . . . . 0.0 112.561 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 25.8 m-85 -111.89 136.31 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.159 177.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.55 156.53 31.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.12 0.486 . . . . 0.0 111.613 -179.342 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.431 HG23 ' HB3' ' A' ' 26' ' ' LEU . 87.9 t -125.43 113.96 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.48 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.408 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 3.3 tt0 -111.93 141.32 45.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.475 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.1 123.44 39.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.515 0.674 . . . . 0.0 111.575 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.421 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.29 107.59 0.28 Allowed Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.823 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.37 118.37 22.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.688 0.28 . . . . 0.0 110.553 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.03 174.21 10.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.011 0.434 . . . . 0.0 111.551 -179.402 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.4 p -83.57 -17.04 43.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.093 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -112.55 128.34 56.33 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.85 0.357 . . . . 0.0 111.174 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.513 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.53 -34.74 64.96 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.082 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -52.23 -32.0 34.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.045 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.427 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.9 m120 -70.89 -49.6 44.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.417 ' HB2' ' CG1' ' A' ' 75' ' ' VAL . . . -58.46 -40.54 82.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.012 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -61.66 -49.98 74.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.761 0.315 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 m -59.48 -34.76 72.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.837 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -71.01 -51.52 24.95 Favored 'General case' 0 CA--C 1.503 -0.843 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.5 ' CA ' HG12 ' A' ' 12' ' ' VAL . . . -54.09 -58.25 8.03 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.922 -177.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.67 -37.26 63.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.662 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -64.19 -38.73 92.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.777 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.469 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.79 -41.05 96.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.67 -46.38 89.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -69.79 -26.09 64.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.803 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.446 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.76 -22.85 53.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.404 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.25 23.59 5.42 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.466 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.568 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.72 148.8 52.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.4 t70 -92.34 73.53 5.29 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.675 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -85.43 142.79 28.99 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.116 0.484 . . . . 0.0 111.985 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.9 pt -134.69 162.01 39.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.417 ' CG1' ' HB2' ' A' ' 59' ' ' ALA . 90.0 t -112.29 137.03 46.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt -139.97 140.18 36.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.323 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 11.6 tp -92.03 107.42 19.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.306 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -100.82 131.07 46.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.181 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.833 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.81 94.46 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.929 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -66.19 165.91 12.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.96 163.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.885 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.77 -35.82 6.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.919 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.42 -175.93 4.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -167.51 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -78.05 -174.05 42.29 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.572 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 93.0 mt -143.84 140.38 29.8 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -100.83 106.63 18.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.074 0.464 . . . . 0.0 110.069 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -126.31 156.77 39.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.52 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.48 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -107.92 138.99 31.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.316 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.145 179.761 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -131.22 133.75 45.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.717 0.294 . . . . 0.0 111.158 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.468 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.55 -5.64 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.41 175.21 29.08 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.055 -1.545 . . . . 0.0 114.558 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.62 142.54 23.0 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.995 -0.603 . . . . 0.0 109.426 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.404 ' O ' ' HB2' ' A' ' 46' ' ' TYR . 2.8 m-85 -147.53 150.13 33.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.878 0.37 . . . . 0.0 111.346 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 29.3 pttt -61.72 -13.63 24.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.489 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.27 127.04 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.176 0.512 . . . . 0.0 111.959 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.465 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.09 -42.12 80.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.574 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.23 -31.69 63.77 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.148 0.499 . . . . 0.0 110.02 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -78.22 -34.94 49.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.5 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -19.21 61.04 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.881 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.95 -37.66 20.24 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.496 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -37.73 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.453 ' CG ' HG13 ' A' ' 14' ' ' ILE . 59.6 tp -66.26 -51.63 55.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.127 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.67 -23.87 53.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.534 178.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -41.15 64.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.63 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.08 -46.98 86.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.461 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -62.1 -40.41 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -55.28 -37.11 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.275 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.17 -50.81 66.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.376 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.3 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.07 32.3 3.08 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.537 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.1 m-85 -100.55 155.8 17.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.949 0.404 . . . . 0.0 110.858 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.44 92.41 8.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.697 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 96.4 p -80.12 157.4 26.65 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.175 0.512 . . . . 0.0 110.894 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.85 142.35 6.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.739 -178.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.615 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -121.8 122.41 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.272 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -114.79 125.24 53.47 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.424 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tp -85.2 114.05 22.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.46 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.604 ' O ' ' N ' ' A' ' 44' ' ' GLY . 0.1 OUTLIER -101.05 167.18 10.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.089 178.244 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.561 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.2 m-20 -56.02 64.0 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 127.94 -12.4 6.49 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 120.341 -0.933 . . . . 0.0 114.654 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.557 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 18.0 mt -144.61 152.86 41.12 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.015 0.907 . . . . 0.0 112.908 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.493 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 25.8 m-85 -109.34 129.69 55.52 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.407 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.615 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -103.76 147.03 27.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.917 0.389 . . . . 0.0 111.831 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.448 HG11 HD12 ' A' ' 14' ' ' ILE . 98.7 t -120.96 105.2 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.737 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 15.3 tt0 -111.86 142.04 44.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.416 -179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.461 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.38 123.78 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-O 121.588 0.708 . . . . 0.0 111.561 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.08 106.32 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.872 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.11 117.45 20.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.666 0.269 . . . . 0.0 110.492 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -137.09 170.11 16.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.138 0.494 . . . . 0.0 111.422 -179.334 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -17.08 53.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.47 131.71 56.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.95 0.405 . . . . 0.0 110.947 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.498 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 5.0 ttpt -57.63 -37.96 74.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.376 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -46.04 -32.98 3.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.049 0.452 . . . . 0.0 110.854 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.445 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 13.2 m120 -71.91 -49.2 39.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.411 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.06 -44.57 87.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.084 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.29 -52.31 66.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.76 0.314 . . . . 0.0 111.209 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.04 -34.58 72.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.103 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.489 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.3 -51.9 26.86 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.718 0.77 . . . . 0.0 110.135 179.429 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.48 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.5 -59.13 5.11 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.029 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.72 -37.21 50.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.276 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.0 -38.25 90.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.784 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.446 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.34 -41.91 93.44 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.762 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.9 mttm -62.09 -46.83 87.35 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.638 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.58 -25.29 63.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.811 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.423 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.2 -23.3 51.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.336 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.64 23.36 5.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.412 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.18 149.18 52.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.2 t70 -92.98 74.59 4.78 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.662 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.5 143.41 28.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.135 0.493 . . . . 0.0 111.778 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.5 pt -134.69 151.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.837 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 88.1 t -103.61 135.78 39.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt -138.71 140.45 39.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.26 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.9 tp -94.11 106.05 18.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.16 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -99.08 117.87 34.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.232 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.86 179.93 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.804 0.335 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.68 90.97 2.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -164.93 159.56 18.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.865 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.8 p 50.52 -177.92 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 79.2 p -102.83 -75.12 0.61 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.5 101.48 0.25 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.931 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.92 131.53 19.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.946 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.81 125.03 3.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.537 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 6.7 mt -144.27 141.51 29.87 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.516 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.6 m-85 -101.86 106.79 17.81 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.142 0.496 . . . . 0.0 109.874 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -125.05 154.41 41.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.649 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -108.33 137.02 42.06 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.205 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -129.6 135.46 48.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.651 0.263 . . . . 0.0 111.008 -179.391 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -106.23 -5.03 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.64 173.52 28.22 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 118.964 -1.589 . . . . 0.0 114.559 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.87 143.49 23.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.861 -0.669 . . . . 0.0 109.29 178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.41 ' O ' ' HB2' ' A' ' 46' ' ' TYR . 2.9 m-85 -150.03 148.29 28.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.89 0.376 . . . . 0.0 111.393 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 12.1 pttt -60.8 -13.88 18.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.609 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.08 124.46 61.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.158 0.504 . . . . 0.0 112.116 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -64.93 -44.69 88.68 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.602 179.634 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.65 -31.77 48.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.15 0.5 . . . . 0.0 109.856 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.92 -35.77 50.17 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.593 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.05 -21.51 61.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -37.72 24.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -64.46 -37.18 86.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 109.626 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.543 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 26.8 tp -67.41 -50.8 57.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.331 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.37 -26.39 52.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.083 0.468 . . . . 0.0 110.652 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.34 -41.04 61.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.084 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.543 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.45 -48.92 79.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.962 0.41 . . . . 0.0 110.772 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.531 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -61.14 -39.32 89.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -54.36 -37.15 64.61 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.16 -50.54 64.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.429 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpp? -62.41 -28.37 69.74 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 33.83 2.82 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.501 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 7.2 m-85 -102.05 159.89 14.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.989 0.423 . . . . 0.0 110.626 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -87.56 94.06 9.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.7 p -80.42 157.91 26.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.007 0.432 . . . . 0.0 110.789 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.42 140.12 6.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.007 -178.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.584 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 30.1 t -118.99 118.79 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.75 125.9 54.23 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.002 0.429 . . . . 0.0 110.572 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.497 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.1 tp -86.14 114.31 22.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.209 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.612 ' O ' ' N ' ' A' ' 44' ' ' GLY . 0.1 OUTLIER -102.14 167.14 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.568 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.6 p-10 -56.18 63.8 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.612 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 128.83 -13.77 6.07 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.367 -0.92 . . . . 0.0 114.778 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.572 ' H ' ' HG3' ' A' ' 42' ' ' LYS . 12.4 mt -144.49 151.97 39.92 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.072 0.936 . . . . 0.0 113.197 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.497 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 26.2 m-85 -108.2 128.35 54.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.312 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.584 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -102.72 146.5 28.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.229 0.537 . . . . 0.0 111.872 -178.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.467 HG12 HD13 ' A' ' 14' ' ' ILE . 88.4 t -121.79 103.4 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.621 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.403 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 9.1 tt0 -110.62 143.64 40.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.634 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.462 HG12 ' CD1' ' A' ' 14' ' ' ILE . 1.8 pp -136.18 123.1 32.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.58 0.705 . . . . 0.0 111.618 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.66 111.78 0.3 Allowed Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.145 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.99 112.72 11.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.248 . . . . 0.0 110.371 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -129.65 173.77 10.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 0.0 111.522 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 m -83.81 -17.66 40.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.967 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.8 131.94 56.04 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.873 0.368 . . . . 0.0 111.078 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpp -58.06 -39.62 78.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.271 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -46.07 -32.52 2.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.96 0.409 . . . . 0.0 110.761 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.422 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 71.0 m-80 -70.98 -49.64 43.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.367 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.49 -41.02 75.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.04 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -61.45 -49.26 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.87 0.367 . . . . 0.0 110.902 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -60.92 -34.93 75.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.855 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.49 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.88 -53.05 16.55 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.877 0.846 . . . . 0.0 110.047 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.71 -58.83 5.99 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.141 -1.391 . . . . 0.0 110.853 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.86 -37.77 53.43 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.413 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.8 ttt180 -64.86 -39.41 93.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.752 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.455 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.03 -41.76 94.96 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.603 179.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 29.9 mttt -62.05 -47.14 86.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.695 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -69.14 -25.59 64.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.723 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.445 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.68 -22.22 54.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.271 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.85 23.74 5.78 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -129.99 148.58 51.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.392 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.478 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.7 t0 -92.06 73.85 5.53 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.926 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.466 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.01 140.57 30.93 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.05 0.452 . . . . 0.0 111.913 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 20.7 pt -133.34 152.11 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.922 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 96.6 t -103.17 138.18 28.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.898 0.38 . . . . 0.0 111.156 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 pt -141.44 138.78 32.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.351 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.432 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.9 tp -95.57 105.8 17.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.172 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -129.04 151.76 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 68.2 m . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.905 179.88 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.809 0.337 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -103.51 81.64 1.94 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.15 -31.33 43.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -124.51 164.93 18.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.98 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 51.0 m -66.63 -29.64 69.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.961 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.6 t 63.85 126.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.824 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -174.77 -41.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.84 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -172.43 -167.09 31.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.381 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt -143.84 139.02 29.07 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.5 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -101.28 106.38 17.57 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.064 0.459 . . . . 0.0 109.971 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.12 154.3 41.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.458 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.492 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.58 140.5 24.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.19 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -133.37 135.29 44.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 111.243 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.473 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -108.06 -5.43 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.229 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.33 174.23 28.8 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 118.968 -1.587 . . . . 0.0 114.646 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.402 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.21 141.42 22.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.939 -0.631 . . . . 0.0 109.389 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -147.27 149.54 33.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.973 0.416 . . . . 0.0 111.377 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.54 -12.83 16.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.553 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.09 125.93 63.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.078 0.466 . . . . 0.0 112.072 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.456 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 10.4 tmtt? -67.02 -42.02 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.414 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.63 -31.32 62.19 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.178 0.514 . . . . 0.0 109.909 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -78.36 -33.96 48.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.473 178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.07 -20.1 60.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -37.54 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -38.41 87.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.326 0.584 . . . . 0.0 109.512 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.461 ' CG ' HG13 ' A' ' 14' ' ' ILE . 41.8 tp -66.26 -51.49 57.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.21 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.0 55.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.579 178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t -72.92 -41.41 64.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.572 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.459 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.23 -47.03 86.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.568 179.834 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.468 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -61.58 -40.66 95.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.507 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -55.11 -37.26 66.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.312 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.28 67.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.171 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.36 -28.49 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.656 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.04 31.5 3.31 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.416 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.1 m-85 -100.18 156.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.984 0.421 . . . . 0.0 110.777 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -85.68 93.33 8.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.728 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.7 p -80.43 157.6 26.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.23 0.538 . . . . 0.0 110.873 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.34 140.1 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.754 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.576 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.15 116.31 51.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.272 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.408 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -110.27 123.59 50.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.844 0.354 . . . . 0.0 110.697 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.52 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tp -88.02 115.37 25.45 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.148 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.68 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -101.49 166.69 10.59 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.502 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 8.9 t0 -55.26 65.68 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.615 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.31 -23.62 3.64 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.202 -0.999 . . . . 0.0 115.156 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.68 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 25.5 mt -141.01 161.15 38.53 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 118.215 1.008 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 26.9 m-85 -112.23 133.76 54.16 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.723 178.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.576 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.79 148.78 28.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.056 0.455 . . . . 0.0 111.733 -179.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.422 HG13 HD12 ' A' ' 14' ' ' ILE . 90.5 t -121.31 100.9 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.653 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.405 ' CG ' ' O ' ' A' ' 12' ' ' VAL . 14.1 tt0 -107.51 142.1 37.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.162 -179.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.468 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.0 123.59 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-O 121.653 0.74 . . . . 0.0 111.658 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.92 105.58 0.26 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.701 -1.136 . . . . 0.0 113.002 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.61 112.68 14.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.754 0.311 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.28 171.69 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.066 0.46 . . . . 0.0 111.62 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -17.45 50.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.8 t -114.44 132.67 56.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.018 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.5 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.8 ttpp -58.24 -37.68 75.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.336 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -46.47 -32.13 3.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.109 0.48 . . . . 0.0 110.825 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.446 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 30.5 m120 -72.57 -49.58 31.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.35 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.407 ' HB3' ' CG1' ' A' ' 75' ' ' VAL . . . -57.46 -44.74 85.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.157 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -59.71 -50.35 74.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.826 0.346 . . . . 0.0 110.987 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.0 m -60.17 -35.23 74.88 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.806 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.492 ' HB3' ' CG2' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -52.01 27.54 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-O 121.811 0.815 . . . . 0.0 109.989 179.493 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.485 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.6 -58.72 6.38 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.179 -1.373 . . . . 0.0 111.066 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.27 -36.42 52.7 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.385 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt180 -65.82 -39.17 90.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.702 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -63.99 -41.16 97.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.574 178.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 36.8 mttm -61.88 -46.07 91.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.751 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -70.16 -25.48 63.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.806 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.07 -23.11 52.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.239 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.15 24.0 5.29 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.407 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.555 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.31 147.82 52.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 13.0 t70 -92.31 74.44 5.32 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.689 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.473 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -84.89 142.71 29.51 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.105 0.479 . . . . 0.0 111.908 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -133.94 153.04 35.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.855 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.407 ' CG1' ' HB3' ' A' ' 59' ' ' ALA . 79.0 t -102.83 136.06 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.955 0.407 . . . . 0.0 111.123 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt -136.27 135.05 49.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.106 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 15.0 tp -96.18 105.65 17.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.251 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -99.31 125.51 44.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.029 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.882 179.953 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.0 tp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.936 0.398 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -144.51 31.43 1.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.934 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -138.64 -47.2 0.5 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.958 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.6 p -94.6 44.49 1.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.81 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -44.93 82.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.906 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.2 m -144.78 102.41 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.864 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -126.74 79.27 1.86 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.031 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.09 -136.93 5.47 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.394 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 0.7 OUTLIER -144.05 139.2 28.82 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.8 m-85 -101.33 106.66 17.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 110.097 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -124.84 154.06 41.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.462 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.477 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.57 139.73 27.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.33 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -131.79 133.09 44.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.733 0.301 . . . . 0.0 111.058 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.477 HD12 HG11 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.58 -5.46 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -179.048 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.57 175.45 28.51 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 119.123 -1.513 . . . . 0.0 114.553 178.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.81 145.36 24.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.946 -0.627 . . . . 0.0 109.342 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -149.11 153.1 37.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.123 0.487 . . . . 0.0 111.531 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.417 ' CG ' ' CD2' ' A' ' 45' ' ' LEU . 20.4 mttp -61.42 -16.78 50.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.255 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -106.93 129.25 60.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 112.182 -179.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.6 OUTLIER -70.57 -39.89 73.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.316 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.03 -32.84 66.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 0.0 109.9 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -76.58 -34.66 58.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.254 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.65 -18.47 61.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.826 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -37.7 21.01 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.513 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.6 t -66.02 -38.04 87.43 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.452 ' CG ' HG13 ' A' ' 14' ' ' ILE . 57.3 tp -65.6 -51.34 60.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.058 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.04 -23.91 56.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.493 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.0 t -72.8 -41.25 65.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.545 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -59.55 -47.97 83.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.541 179.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.466 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.55 -41.22 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.605 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.91 -37.43 66.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.36 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.06 69.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.359 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 12.6 mmtt -62.29 -28.28 69.61 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.72 31.33 3.21 Favored Glycine 0 N--CA 1.442 -0.918 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.608 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -101.6 158.81 15.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.915 0.388 . . . . 0.0 110.853 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.92 93.94 9.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.816 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.6 p -80.4 157.94 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.997 0.427 . . . . 0.0 110.813 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -158.48 140.7 5.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.92 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.572 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.37 117.46 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.07 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.41 HD13 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -115.14 126.83 55.09 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.996 0.427 . . . . 0.0 110.647 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.504 HD12 ' O ' ' A' ' 42' ' ' LYS . 4.9 tp -88.0 113.81 24.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.66 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.23 166.9 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.499 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.1 t0 -53.97 64.91 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.639 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 135.19 -23.13 3.51 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 120.129 -1.034 . . . . 0.0 115.254 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.66 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 18.2 mt -143.28 163.44 32.96 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.366 1.083 . . . . 0.0 112.852 -178.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.494 ' CE1' HD13 ' A' ' 41' ' ' LEU . 30.5 m-85 -110.36 132.28 54.32 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.331 177.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.572 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.04 147.66 29.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.172 0.51 . . . . 0.0 111.955 -179.159 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.477 HG11 HD12 ' A' ' 14' ' ' ILE . 94.9 t -120.29 104.19 15.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -109.6 141.26 42.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.359 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.46 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.3 123.7 39.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.602 0.715 . . . . 0.0 111.597 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.48 108.97 0.29 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.925 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.71 112.87 13.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.728 0.299 . . . . 0.0 110.377 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.16 170.38 14.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 111.432 -179.285 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 t -79.64 -18.27 51.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.027 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -115.33 137.87 51.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.92 0.39 . . . . 0.0 111.109 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -61.49 -38.9 88.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.634 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -45.83 -31.77 2.25 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.962 0.411 . . . . 0.0 111.016 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.433 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 62.7 m-80 -73.14 -49.06 30.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.4 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -57.12 -43.3 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.991 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -60.91 -49.35 77.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.811 0.338 . . . . 0.0 110.938 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.1 m -61.17 -33.86 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.489 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -71.52 -52.49 18.02 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 121.739 0.78 . . . . 0.0 109.934 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.477 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.98 -57.86 9.96 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.787 -178.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.17 -37.72 55.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.41 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.1 ttt85 -65.21 -37.94 88.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.821 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.455 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.52 -42.83 91.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.611 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.3 mmmm -61.34 -46.56 89.74 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.854 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -70.24 -25.41 63.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.738 178.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.424 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.77 -22.96 53.0 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.56 23.43 5.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.483 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.585 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.87 148.12 52.6 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 32.4 t70 -91.89 75.04 5.65 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.565 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -85.63 141.69 29.61 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.846 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.2 pp -133.27 153.04 36.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.911 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.4 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 76.9 t -104.86 137.18 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.031 0.443 . . . . 0.0 111.14 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.7 pt -136.96 136.4 47.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.208 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.1 tp -102.62 106.2 16.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -103.22 135.49 44.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.051 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.887 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.857 0.361 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.83 -166.63 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.78 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.89 -77.11 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.892 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -87.87 161.37 17.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.829 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -82.75 111.5 18.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.958 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.1 m 63.38 141.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 m -102.02 41.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.792 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -152.35 153.56 24.97 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.483 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.7 mt -144.04 140.5 29.56 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.742 0.306 . . . . 0.0 110.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.8 m-85 -102.32 106.48 17.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.114 0.483 . . . . 0.0 109.968 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.6 mttt -124.51 154.78 40.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.467 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -104.68 145.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.309 179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -137.78 134.01 34.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.5 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.2 -5.41 10.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.77 169.47 27.31 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 119.256 -1.45 . . . . 0.0 114.623 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -150.93 140.75 21.85 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -151.38 150.08 30.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 111.291 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -60.81 -13.81 17.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.478 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.05 128.9 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-O 120.897 0.38 . . . . 0.0 111.794 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HD2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -71.8 -40.97 68.83 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.682 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.92 -29.51 20.46 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.232 0.539 . . . . 0.0 109.725 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -81.82 -31.88 31.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.726 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.76 -23.08 58.48 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.03 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -83.02 -40.36 20.04 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.624 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -37.29 86.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.211 0.529 . . . . 0.0 109.775 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.537 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 31.2 tp -68.21 -47.53 67.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.279 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.58 -25.85 63.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.046 0.45 . . . . 0.0 110.503 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -74.75 -41.08 60.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.045 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.537 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.05 -48.71 80.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.813 0.34 . . . . 0.0 110.627 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.503 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.88 -38.18 89.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.382 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -54.63 -36.88 64.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.398 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.99 -50.17 64.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.434 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.521 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.32 -28.0 69.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.27 32.25 3.53 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.188 -0.914 . . . . 0.0 112.383 179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 7.0 m-85 -99.18 154.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.973 0.416 . . . . 0.0 110.724 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -81.54 92.51 6.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.004 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 93.5 p -79.69 155.25 28.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.123 0.487 . . . . 0.0 110.927 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.39 140.92 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.822 -178.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.599 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 42.3 t -118.59 118.17 57.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.118 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.65 126.76 54.57 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-O 121.065 0.46 . . . . 0.0 110.561 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.543 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.5 tp -87.8 113.02 23.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.064 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.656 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -96.6 166.91 11.44 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.469 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -55.92 67.15 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 136.11 -25.37 3.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 120.165 -1.017 . . . . 0.0 114.942 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.656 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 16.7 mt -143.18 167.09 22.94 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.081 0.94 . . . . 0.0 112.953 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.543 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 30.6 m-85 -112.83 134.69 54.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.623 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.599 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -109.22 151.18 26.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.161 0.505 . . . . 0.0 111.784 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' A' ' 26' ' ' LEU . 86.5 t -123.9 102.19 10.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.565 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.7 141.98 37.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.89 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.482 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -134.55 123.1 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.61 0.719 . . . . 0.0 111.246 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.415 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.45 104.63 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.849 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.73 124.02 40.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.646 0.26 . . . . 0.0 110.666 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.04 174.36 10.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.036 0.446 . . . . 0.0 111.404 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -83.49 -16.7 44.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.74 130.59 56.41 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.977 0.418 . . . . 0.0 111.172 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.493 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.69 -34.66 67.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.164 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -52.34 -32.57 38.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 0.0 111.07 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.443 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 2.6 m120 -70.26 -48.45 56.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.693 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.422 ' HB2' ' CG1' ' A' ' 75' ' ' VAL . . . -61.24 -39.98 92.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.841 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -60.16 -51.78 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 62' ' ' LEU . 15.4 t -58.91 -34.75 72.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 0.0 110.855 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.483 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.4 -50.96 33.15 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.741 0.781 . . . . 0.0 110.049 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.489 ' CA ' HG12 ' A' ' 12' ' ' VAL . . . -53.0 -58.19 7.8 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.044 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.6 -35.46 65.84 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.65 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -63.96 -40.9 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 179.083 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.478 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.35 -40.07 95.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.451 178.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.607 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.0 mmmm -61.71 -47.24 86.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.719 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -26.34 65.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.809 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.455 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.67 -21.93 54.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.587 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.66 23.21 5.74 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.385 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.607 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.58 148.97 52.44 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 8.3 t0 -92.08 74.72 5.51 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.807 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.5 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -86.8 143.16 27.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.911 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -136.46 162.95 34.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.7 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.422 ' CG1' ' HB2' ' A' ' 59' ' ' ALA . 95.7 t -111.58 136.77 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.959 0.409 . . . . 0.0 111.013 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 9.8 tt -140.78 140.01 33.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.12 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.402 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.2 tp -89.54 117.88 28.76 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.139 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -88.44 101.04 13.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 61.4 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.884 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.848 0.356 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -107.72 97.28 7.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.25 -39.8 5.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.895 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -149.38 175.59 11.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -176.51 -42.74 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.9 m 59.62 83.2 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.81 22.48 3.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.13 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.75 -158.83 17.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.574 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.7 mp -144.22 142.47 30.52 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.503 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -100.9 107.28 18.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.146 0.498 . . . . 0.0 110.018 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -127.2 155.74 42.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.596 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.47 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.1 137.58 38.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.2 179.829 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -130.36 133.3 46.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.336 . . . . 0.0 111.024 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.484 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -104.8 -4.79 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.67 174.73 28.76 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 119.05 -1.548 . . . . 0.0 114.674 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -151.34 140.37 21.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -144.75 148.84 34.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.834 0.35 . . . . 0.0 111.401 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 25.7 tttt -61.06 -14.42 23.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.448 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.2 t -107.17 128.94 61.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.092 0.472 . . . . 0.0 111.92 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.4 OUTLIER -68.72 -42.74 77.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.579 179.655 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.87 -32.04 60.33 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 109.852 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -77.45 -35.16 54.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.315 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.31 -18.97 61.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.771 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.81 -37.62 20.55 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.488 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.4 t -65.03 -37.0 86.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 33.7 tp -68.49 -50.41 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.198 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.45 -26.07 52.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -40.49 60.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.146 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.546 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.65 -48.71 80.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.919 0.39 . . . . 0.0 110.665 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.535 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -61.72 -39.06 90.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.359 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -54.67 -37.13 65.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.336 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.11 -49.59 68.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.425 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.0 mmtt -62.28 -28.3 69.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.29 32.88 3.09 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.473 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.499 ' CD2' HD13 ' A' ' 62' ' ' LEU . 7.3 m-85 -101.82 159.08 15.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.983 0.421 . . . . 0.0 110.682 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -87.04 94.69 9.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.879 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 87.4 p -80.38 157.04 26.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.09 0.472 . . . . 0.0 110.818 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.91 141.69 6.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.771 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 20.6 t -119.69 117.93 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.494 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.33 122.6 47.72 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.874 0.369 . . . . 0.0 110.77 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.9 tp -84.13 111.62 19.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.159 0.504 . . . . 0.0 111.091 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.596 ' O ' ' N ' ' A' ' 44' ' ' GLY . 0.1 OUTLIER -100.11 167.26 10.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.368 178.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.581 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -55.91 64.62 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.596 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 124.12 -10.16 8.33 Favored Glycine 0 CA--C 1.522 0.525 0 C-N-CA 120.499 -0.857 . . . . 0.0 114.467 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.571 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 27.8 mt -144.15 150.79 38.61 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 117.94 0.87 . . . . 0.0 112.813 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 24.1 m-85 -109.6 131.65 54.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.563 178.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.607 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -105.08 147.79 27.51 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.17 0.509 . . . . 0.0 112.022 -179.473 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.482 HG11 HD13 ' A' ' 14' ' ' ILE . 93.7 t -120.67 101.64 11.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.362 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -109.02 142.25 39.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.595 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.469 HG12 ' CD1' ' A' ' 14' ' ' ILE . 1.8 pp -135.14 123.38 39.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.539 0.685 . . . . 0.0 111.5 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.24 105.64 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 114.827 -1.078 . . . . 0.0 113.054 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.57 116.36 19.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.778 0.323 . . . . 0.0 110.232 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.58 173.53 11.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.027 0.441 . . . . 0.0 111.604 -179.158 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.42 -17.85 40.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.07 131.92 56.21 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.888 0.375 . . . . 0.0 111.078 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -58.66 -38.96 79.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.397 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -44.98 -33.89 2.21 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.963 0.411 . . . . 0.0 110.782 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.434 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 26.8 m-80 -72.47 -48.78 38.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.331 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.69 -45.23 85.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.001 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.33 -50.65 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.864 0.364 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 5.2 m -58.58 -36.18 73.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.49 -51.61 34.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 121.709 0.766 . . . . 0.0 110.065 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.93 -59.54 4.59 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.026 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.96 -37.89 47.27 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.567 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.983 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.96 -42.93 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.776 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.574 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.46 -47.13 87.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.658 178.83 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -25.86 64.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.74 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.458 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.94 53.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.315 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.33 23.18 5.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.515 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.574 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.21 148.94 52.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.0 t70 -92.93 74.44 4.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.484 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.07 142.06 28.98 Favored 'General case' 0 CA--C 1.524 -0.029 0 CA-C-O 121.108 0.48 . . . . 0.0 111.751 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -133.4 149.91 31.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.03 179.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.72 136.27 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.895 0.379 . . . . 0.0 111.078 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 pt -140.49 142.78 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.25 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.443 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 19.5 tp -95.48 107.54 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.279 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -98.18 124.96 43.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.218 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.916 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 33.9 mt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.2 120.96 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.935 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -126.06 -44.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.987 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -64.52 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.952 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -150.66 142.1 23.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.9 p -107.84 -39.57 5.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.8 t 63.64 126.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -79.14 -172.46 42.49 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.52 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 3.1 mm? -143.31 141.02 30.84 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 45.7 m-85 -101.62 106.35 17.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.058 0.456 . . . . 0.0 109.98 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.2 mttt -125.68 153.18 44.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.689 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.488 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.88 136.65 39.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.164 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -129.69 134.78 47.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.808 0.337 . . . . 0.0 111.163 -179.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.473 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.07 -6.16 10.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -178.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.44 173.06 29.61 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 118.792 -1.671 . . . . 0.0 114.944 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.475 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.17 137.52 18.52 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.467 178.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 46' ' ' TYR . 1.9 m-85 -146.2 149.35 33.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.784 0.326 . . . . 0.0 111.058 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 21.5 tttt -59.69 -14.66 15.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.828 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.51 130.29 60.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.096 0.474 . . . . 0.0 112.049 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -72.23 -40.6 67.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.623 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.62 -34.18 57.62 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.303 0.573 . . . . 0.0 109.791 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -75.32 -32.67 61.02 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.212 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -20.2 60.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.034 179.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -83.34 -38.48 22.0 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.681 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.86 -38.23 85.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.315 0.579 . . . . 0.0 109.646 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.46 ' CG ' HG13 ' A' ' 14' ' ' ILE . 48.6 tp -65.31 -51.1 62.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.149 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.98 -24.85 63.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.574 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.377 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.451 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -59.3 -46.93 87.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.426 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.458 ' CB ' ' CG2' ' A' ' 50' ' ' ILE . . . -58.36 -42.65 87.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.622 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -55.34 -37.28 67.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.311 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.54 -51.54 59.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.296 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.518 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 3.5 mmpt? -63.2 -28.97 70.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.21 33.28 2.79 Favored Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.528 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 5.7 m-85 -101.95 160.14 14.75 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.925 0.393 . . . . 0.0 110.81 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -88.96 94.68 10.03 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.773 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 m -80.6 157.55 25.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.146 0.498 . . . . 0.0 110.861 -178.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -157.7 140.16 5.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.724 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -115.11 112.51 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.282 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.416 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -104.73 121.65 44.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.998 0.428 . . . . 0.0 110.714 179.595 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.8 tp -84.46 110.3 18.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.312 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.585 ' HD2' ' N ' ' A' ' 43' ' ' ASP . 0.0 OUTLIER -94.0 166.32 12.21 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.46 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.585 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 24.1 t0 -57.24 64.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -178.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 126.45 -9.24 7.35 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.468 -0.872 . . . . 0.0 114.371 178.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.557 ' H ' ' HG3' ' A' ' 42' ' ' LYS . 42.7 mt -143.89 152.59 41.34 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 117.586 0.693 . . . . 0.0 112.4 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.472 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 23.8 m-85 -110.85 134.82 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.444 177.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.27 155.51 29.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.967 0.413 . . . . 0.0 111.455 -179.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.417 HG21 ' HB3' ' A' ' 26' ' ' LEU . 59.3 t -125.21 109.91 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.959 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -110.09 142.05 42.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.034 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.458 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.82 122.76 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 121.601 0.715 . . . . 0.0 111.525 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.0 105.0 0.32 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.826 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.41 113.31 15.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.696 0.284 . . . . 0.0 110.429 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -132.15 173.4 11.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.23 0.538 . . . . 0.0 111.389 -179.274 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -16.27 46.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.106 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.93 129.44 56.47 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.892 0.377 . . . . 0.0 111.094 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.4 OUTLIER -56.1 -35.36 66.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.25 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.9 -32.2 31.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.451 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 11.3 m120 -70.34 -49.83 45.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.558 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.401 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -59.3 -41.25 88.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.011 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -60.22 -50.86 72.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.7 0.285 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.8 m -59.0 -36.9 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.511 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.83 -51.43 40.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 121.834 0.826 . . . . 0.0 110.17 179.375 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.488 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.61 -60.3 3.53 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.211 -1.358 . . . . 0.0 111.124 -177.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -36.97 40.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.462 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -65.41 -39.3 91.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.835 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.446 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.7 -41.92 95.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.662 179.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.4 mttt -61.59 -46.65 88.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.698 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -69.74 -25.52 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.691 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.451 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.96 -22.72 52.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.402 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 24.14 5.42 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.548 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.52 148.29 52.3 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.02 72.48 5.55 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.852 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.473 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -84.81 141.39 30.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.1 0.476 . . . . 0.0 111.722 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.462 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 6.9 pt -133.61 152.22 34.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.007 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.401 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 95.9 t -103.39 136.2 37.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.867 0.365 . . . . 0.0 111.039 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.1 tt -138.76 140.8 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.34 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.1 tp -99.38 104.01 15.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.128 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -93.16 115.15 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.023 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.852 179.794 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.835 0.35 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -150.69 114.56 5.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.39 155.18 37.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.9 p -70.19 -174.96 0.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.845 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.7 79.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.9 m -118.83 95.97 5.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.883 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.1 p -116.3 -37.93 3.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -98.51 170.86 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.447 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 15.2 mt -143.99 140.95 29.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -101.83 106.72 17.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -124.8 155.65 39.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.47 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.1 OUTLIER -108.59 141.61 23.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.435 179.627 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 17.7 tt0 -134.47 134.43 41.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.729 0.3 . . . . 0.0 111.319 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.481 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -107.71 -5.11 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.14 172.08 27.99 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 119.071 -1.538 . . . . 0.0 114.82 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.437 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.29 145.51 25.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 178.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -151.63 151.62 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.004 0.431 . . . . 0.0 111.33 -179.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 1.1 tttt -60.45 -15.46 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.422 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.7 t -106.38 128.39 60.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.001 0.429 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.24 -40.46 74.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.3 -33.08 62.96 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.267 0.556 . . . . 0.0 109.739 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -75.97 -33.83 59.77 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.264 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.91 -22.75 61.44 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.775 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.71 -37.21 31.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.596 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -38.58 89.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.215 0.531 . . . . 0.0 109.758 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.522 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 15.2 tp -66.93 -47.28 72.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.23 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.27 -25.61 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 110.578 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -40.52 57.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.018 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -60.25 -48.4 81.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.339 . . . . 0.0 110.626 -179.924 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.512 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.5 -38.76 91.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.255 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -54.96 -36.58 65.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.278 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.62 73.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.229 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.3 -28.17 69.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 31.14 3.55 Favored Glycine 0 N--CA 1.442 -0.936 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.497 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.502 ' CD2' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -100.37 156.92 16.98 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.794 0.331 . . . . 0.0 110.711 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.83 95.41 9.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.999 179.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.1 p -80.24 155.85 27.14 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.201 0.524 . . . . 0.0 111.044 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -155.47 139.88 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.548 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.597 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.8 t -117.87 116.3 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.543 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 HD11 ' N ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -117.98 128.7 55.04 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.864 0.364 . . . . 0.0 110.458 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 6.8 tp -91.36 117.06 29.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.954 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.694 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -107.7 143.85 35.62 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.38 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.449 ' HB2' ' CE ' ' A' ' 42' ' ' LYS . 1.4 m-20 38.73 -85.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.806 0.336 . . . . 0.0 110.692 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.638 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -141.25 14.7 2.77 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.06 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.694 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 17.3 mt -118.47 158.28 25.63 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.016 0.436 . . . . 0.0 111.116 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 22.7 m-85 -116.13 135.5 53.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.178 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.597 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.32 149.4 28.7 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.107 0.48 . . . . 0.0 111.268 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.438 HG21 ' HB3' ' A' ' 26' ' ' LEU . 58.7 t -122.04 100.45 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.609 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 4.5 tt0 -104.75 142.01 35.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.78 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.447 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.03 122.76 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.438 0.637 . . . . 0.0 111.425 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.42 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 82.01 107.38 0.4 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.78 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.7 121.06 29.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.258 . . . . 0.0 110.584 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -141.19 172.31 12.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.111 0.481 . . . . 0.0 111.424 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -83.99 -16.22 44.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.221 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 m -111.63 127.49 55.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.84 0.352 . . . . 0.0 111.198 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -54.82 -36.49 65.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -52.97 -30.03 32.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.417 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -71.81 -49.61 37.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.639 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.41 -40.87 95.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.937 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.24 -50.7 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 m -58.38 -36.57 73.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.674 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.502 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -69.24 -50.04 50.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.746 0.784 . . . . 0.0 110.065 179.355 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.469 ' CA ' HG13 ' A' ' 12' ' ' VAL . . . -53.76 -59.22 4.9 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.284 -1.325 . . . . 0.0 111.135 -177.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.49 -36.1 63.8 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.792 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -40.82 97.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.961 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.472 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -63.81 -39.22 93.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.495 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.591 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.8 mttm -62.66 -46.66 87.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.569 178.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -26.23 64.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.734 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.59 -22.26 54.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.508 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.7 23.15 5.75 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.591 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.33 148.56 52.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.481 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 10.0 t70 -91.93 74.63 5.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.752 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -85.86 142.0 29.2 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.151 0.5 . . . . 0.0 112.117 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -134.07 160.98 41.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.748 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 98.5 t -113.1 137.58 45.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.904 0.383 . . . . 0.0 111.072 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.2 pt -139.55 140.11 37.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.454 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.422 HD11 ' CE1' ' A' ' 10' ' ' TYR . 14.8 tp -92.41 105.75 17.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -96.77 121.74 38.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.046 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.928 179.91 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -79.27 128.25 33.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.41 -171.21 1.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -70.22 -55.24 9.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.993 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 t 62.87 121.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.2 m -146.89 121.96 10.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.78 154.38 35.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.921 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.88 -157.91 14.66 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.353 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 3.0 mm? -143.24 138.6 29.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.519 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.9 m-85 -102.35 106.08 16.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.119 0.485 . . . . 0.0 110.172 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -125.14 153.46 42.98 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.474 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.97 139.99 26.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.342 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -134.33 134.35 41.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.617 0.246 . . . . 0.0 111.236 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.466 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.4 -4.8 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.128 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.58 175.87 29.0 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 118.993 -1.575 . . . . 0.0 114.757 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.43 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.78 148.47 27.9 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -152.76 151.88 31.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.959 0.409 . . . . 0.0 111.441 -179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.65 -14.82 22.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.421 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.46 127.76 64.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.143 0.497 . . . . 0.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.428 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.86 -38.21 73.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.344 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -33.57 67.94 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.172 0.511 . . . . 0.0 109.658 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -75.62 -33.5 60.51 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.115 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.74 -18.54 60.97 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.798 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.55 -36.96 21.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.478 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -38.05 84.19 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.453 ' CG ' HG13 ' A' ' 14' ' ' ILE . 49.0 tp -66.22 -51.6 56.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.105 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.23 -24.37 59.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.306 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -41.04 67.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.587 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.53 -46.95 87.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.45 179.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.463 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.45 -41.18 93.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.45 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -55.05 -36.86 66.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.55 -51.44 62.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.303 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.0 mmpt? -62.6 -28.61 70.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.55 32.83 2.83 Favored Glycine 0 N--CA 1.443 -0.854 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.585 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.496 ' CD2' HD11 ' A' ' 62' ' ' LEU . 4.9 m-85 -101.2 158.51 15.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.698 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -87.38 94.93 9.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.923 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.7 p -80.56 157.01 26.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.15 0.5 . . . . 0.0 110.972 -178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.59 141.08 6.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.643 -178.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.88 116.56 52.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.51 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.429 HD11 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -116.94 129.38 56.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 179.68 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 9.7 tp -91.35 117.64 29.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.191 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.652 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -111.11 151.93 27.54 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.42 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.539 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 32.12 -85.72 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.74 0.305 . . . . 0.0 110.731 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.652 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -139.76 10.34 3.14 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 121.442 -0.408 . . . . 0.0 112.334 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.549 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 10.3 mt -117.42 161.66 19.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.061 0.43 . . . . 0.0 111.612 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 25.6 m-85 -116.22 137.33 52.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.173 178.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.83 146.81 31.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.065 0.459 . . . . 0.0 111.248 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.432 HG11 HD11 ' A' ' 14' ' ' ILE . 72.8 t -117.74 100.33 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.58 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -104.89 140.37 38.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.136 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.457 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.34 123.07 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.562 0.696 . . . . 0.0 111.57 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.401 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.71 106.99 0.25 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 114.739 -1.119 . . . . 0.0 112.879 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.13 115.58 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 110.484 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -134.27 173.5 11.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.227 0.537 . . . . 0.0 111.495 -179.252 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.52 -16.35 45.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.157 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.02 129.2 56.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.829 0.347 . . . . 0.0 111.081 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.519 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.9 OUTLIER -56.25 -35.15 67.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.221 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -52.44 -30.8 31.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.449 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 27.9 m120 -71.86 -49.92 33.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.71 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.86 -41.24 91.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.28 -51.01 71.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.998 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.69 -34.81 73.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.94 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.496 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.32 -51.6 28.96 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.804 0.811 . . . . 0.0 109.892 179.425 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -54.49 -58.91 5.63 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.932 -178.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.32 -37.28 55.44 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.476 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -64.69 -38.93 92.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.823 178.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.67 -41.13 96.3 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.553 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 48.0 mttm -61.85 -46.8 87.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.654 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.66 -25.68 64.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.818 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.45 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.79 -22.41 53.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.278 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.34 24.18 5.47 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.421 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.74 147.98 52.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 23.0 t70 -91.58 73.42 5.93 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.607 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.466 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -83.99 140.92 31.58 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.16 0.505 . . . . 0.0 111.859 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pp -132.07 150.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.88 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.6 t -104.12 134.83 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.848 0.356 . . . . 0.0 110.966 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 pt -134.28 136.9 52.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.127 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.429 HD12 ' CE1' ' A' ' 10' ' ' TYR . 17.8 tp -97.61 105.8 18.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.202 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -95.28 120.35 35.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.011 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.251 1.178 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.843 179.86 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.412 ' CD1' ' N ' ' A' ' 1' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.792 0.33 . . . . 0.0 111.374 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -170.34 106.41 0.31 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.904 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -133.52 -45.89 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.993 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.5 t -135.55 -46.53 0.68 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.918 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t -59.7 121.46 11.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.867 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -156.1 151.73 27.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.5 121.73 45.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 133.04 165.0 11.04 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.3 mt -143.92 140.44 29.71 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.517 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.2 m-85 -101.76 106.53 17.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.177 0.513 . . . . 0.0 110.127 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -126.15 153.24 44.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.344 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.51 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.21 138.44 31.63 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.145 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 16.1 tt0 -132.12 133.38 44.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.717 0.294 . . . . 0.0 111.127 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.488 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -107.34 -4.97 10.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.275 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.56 171.04 28.24 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 119.152 -1.499 . . . . 0.0 115.034 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.449 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 144.46 24.89 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 178.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -152.84 151.05 29.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.534 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -59.46 -15.33 16.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.598 179.593 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.63 128.35 61.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.95 0.405 . . . . 0.0 111.8 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.47 -39.1 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.45 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -32.69 63.56 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -76.34 -32.89 58.92 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.183 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.99 -23.6 61.44 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.722 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -37.46 30.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.717 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -65.48 -38.9 91.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.237 0.541 . . . . 0.0 109.877 179.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.544 ' HG ' HG11 ' A' ' 48' ' ' VAL . 14.7 tp -66.99 -45.91 76.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.232 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.25 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.058 0.456 . . . . 0.0 110.537 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.69 -40.87 61.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.041 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.533 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.6 -48.43 81.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.758 0.313 . . . . 0.0 110.642 179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.521 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.25 -38.26 88.57 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.282 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -54.9 -37.02 65.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.232 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.72 67.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.423 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.51 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.35 -28.28 69.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.625 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.42 33.37 3.16 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.438 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 7.3 m-85 -100.75 156.28 17.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.94 0.4 . . . . 0.0 110.779 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.02 94.51 8.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.84 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.9 p -80.23 155.51 27.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.206 0.527 . . . . 0.0 111.126 -178.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.62 137.7 7.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.717 -178.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.545 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -117.6 115.69 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.38 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.402 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -119.83 134.86 55.09 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.438 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 15.2 tp -94.77 118.07 31.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.95 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.68 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -110.03 152.9 25.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.366 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.529 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER 30.38 -86.91 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.215 0.322 . . . . 0.0 110.815 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.68 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -137.38 9.96 3.78 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 121.182 -0.532 . . . . 0.0 112.253 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.54 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 10.6 mt -117.34 160.52 20.99 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.042 0.449 . . . . 0.0 111.584 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.5 m-85 -115.3 136.55 52.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.076 178.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.82 149.62 28.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.186 0.517 . . . . 0.0 111.412 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.544 HG11 ' HG ' ' A' ' 26' ' ' LEU . 42.6 t -122.54 99.37 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.445 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 0.4 OUTLIER -104.66 142.22 35.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.984 -179.282 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.481 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -134.55 122.59 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 111.396 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.435 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.96 104.81 0.26 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 114.818 -1.083 . . . . 0.0 112.867 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.24 125.4 40.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -144.25 173.67 11.56 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.135 0.493 . . . . 0.0 111.574 -179.337 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 97.1 p -83.47 -16.59 45.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.062 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.42 129.74 56.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.886 0.374 . . . . 0.0 111.078 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.9 -34.85 68.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.237 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -51.52 -31.9 25.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.883 0.373 . . . . 0.0 111.134 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.44 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 73.3 m-80 -71.68 -49.57 38.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.697 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.45 -43.32 96.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.44 -51.44 69.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.931 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 70.6 m -57.88 -37.15 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.878 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -68.77 -51.12 44.45 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.714 0.768 . . . . 0.0 110.304 179.555 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.51 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -54.02 -59.67 4.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.099 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.73 -36.6 57.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.507 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.26 -39.6 94.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.765 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.461 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.64 -40.46 95.49 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.533 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.567 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.7 mttm -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.588 178.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -68.58 -25.94 65.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.846 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.458 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.97 -22.26 53.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.5 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 23.13 5.88 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.418 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.567 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.34 148.96 52.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.379 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.488 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.6 t70 -92.63 74.67 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.958 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.37 140.67 30.58 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.105 0.478 . . . . 0.0 111.907 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 11.3 pt -132.89 150.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.969 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 99.3 t -103.91 136.83 35.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.077 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt -137.34 139.2 44.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.347 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.447 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.1 tp -103.75 105.1 15.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.362 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -125.46 147.79 49.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.13 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.203 -0.904 . . . . 0.0 110.816 179.919 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.915 0.388 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.41 -47.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -105.53 92.09 4.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.5 m -130.19 -46.12 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.6 m -170.54 128.12 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.01 34.68 2.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.907 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.82 -30.65 11.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.02 162.1 30.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.506 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 0.5 OUTLIER -143.9 139.29 29.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.4 m-85 -101.5 106.62 17.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.088 0.47 . . . . 0.0 109.896 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -125.54 152.46 45.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.451 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.59 136.65 38.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.283 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -128.06 135.48 49.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.598 0.237 . . . . 0.0 111.111 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -107.32 -6.14 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.61 173.08 29.82 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 118.795 -1.669 . . . . 0.0 115.374 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.34 142.68 23.38 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 114.62 -0.79 . . . . 0.0 108.949 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -153.33 150.38 28.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.949 0.405 . . . . 0.0 111.331 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -59.89 -15.38 21.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.617 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -107.88 127.27 64.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.005 0.431 . . . . 0.0 111.826 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.33 -38.26 68.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.658 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.29 -34.92 61.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.249 0.547 . . . . 0.0 109.591 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -73.98 -32.37 63.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.124 178.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.78 -19.99 60.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.978 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -82.12 -38.72 24.35 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.733 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -36.75 79.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.245 0.545 . . . . 0.0 109.799 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.456 ' CG ' HG13 ' A' ' 14' ' ' ILE . 51.0 tp -65.52 -51.95 56.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.472 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.11 -28.48 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -41.7 85.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.617 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.481 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -59.8 -47.92 83.78 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.692 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.481 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -58.76 -42.1 88.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.673 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.9 -37.17 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.395 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.23 -51.11 63.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.344 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpt? -62.61 -28.76 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.3 32.78 2.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.488 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.0 m-85 -102.11 159.82 15.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.959 0.409 . . . . 0.0 110.716 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -88.33 94.88 9.98 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.907 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 78.2 p -80.69 156.62 26.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.155 0.503 . . . . 0.0 110.91 -178.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.92 135.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -178.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -112.06 112.04 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.111 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.546 ' O ' ' HD3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -114.67 132.21 56.47 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.857 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 40' ' ' LEU . 10.8 tp -90.67 111.88 23.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.3 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.7 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.5 OUTLIER -104.67 152.46 22.46 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.423 ' C ' ' O ' ' A' ' 42' ' ' LYS . 2.3 t70 32.99 -83.18 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.844 0.354 . . . . 0.0 111.256 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.646 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -144.91 17.33 1.97 Allowed Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.7 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 8.8 mt -126.21 166.44 17.08 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.123 0.487 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.427 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 26.2 m-85 -117.4 138.56 51.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.758 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -119.08 156.52 29.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.986 0.422 . . . . 0.0 110.806 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.447 HG21 ' HB3' ' A' ' 26' ' ' LEU . 58.7 t -124.62 109.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.357 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -107.41 140.99 39.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.473 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.472 ' CG2' ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.71 122.95 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.536 0.684 . . . . 0.0 111.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.413 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.58 104.96 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.871 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.95 112.65 14.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -130.39 171.05 13.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.078 0.466 . . . . 0.0 111.472 -179.188 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 t -80.83 -17.75 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.032 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -113.16 130.92 56.05 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.81 0.338 . . . . 0.0 111.053 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.9 ttpt -57.08 -38.85 73.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.72 -31.38 2.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.099 0.476 . . . . 0.0 110.776 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.446 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 33.4 m120 -72.21 -49.76 32.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.319 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.415 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -56.87 -43.32 81.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.118 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.29 -49.61 76.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.861 0.362 . . . . 0.0 110.843 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.7 m -60.18 -35.43 75.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.29 -52.87 19.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.874 0.845 . . . . 0.0 110.147 179.371 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.48 -58.92 5.57 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.899 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.63 -37.76 51.68 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt-85 -65.29 -37.97 88.8 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.798 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.42 -42.5 92.42 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.783 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 18.6 mttm -61.54 -46.51 89.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.696 178.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.78 -25.34 63.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.658 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.456 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.39 -23.17 50.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.283 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.05 23.97 5.33 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.524 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.04 148.76 52.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.467 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 12.8 t70 -92.24 73.48 5.38 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.446 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -86.1 140.42 30.24 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.079 0.466 . . . . 0.0 111.681 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.0 OUTLIER -132.87 152.35 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.003 179.211 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.415 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 86.7 t -101.65 138.04 27.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.943 0.401 . . . . 0.0 111.051 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.0 pt -141.3 138.14 33.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.252 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.4 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 11.7 tp -91.25 107.27 19.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.288 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -100.4 124.86 46.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.053 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.9 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 mt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.78 0.324 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.39 -31.58 7.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.993 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -148.2 142.99 26.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 58.0 m 60.33 102.8 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.82 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.09 78.67 7.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.983 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.69 127.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.817 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.8 p -149.72 123.8 9.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.29 151.31 8.52 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.409 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.2 mt -143.96 139.67 29.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -101.39 106.29 17.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.016 0.436 . . . . 0.0 110.209 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.33 154.37 43.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.607 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.485 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -106.31 140.03 25.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.277 179.821 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -132.09 136.95 47.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.743 0.306 . . . . 0.0 111.145 -179.13 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.476 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.97 -6.28 11.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -179.037 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.78 172.71 29.52 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.892 -1.623 . . . . 0.0 115.021 178.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.471 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.97 134.34 16.2 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 114.856 -0.672 . . . . 0.0 109.474 178.406 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 46' ' ' TYR . 2.6 m-85 -143.34 149.0 37.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.38 -12.0 12.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.894 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.55 129.06 63.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.951 0.405 . . . . 0.0 112.033 -179.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.4 ttpt -70.31 -41.53 73.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.684 179.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.38 -33.71 54.82 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.217 0.532 . . . . 0.0 109.803 179.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -76.48 -32.29 58.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.321 178.459 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.68 -21.18 60.34 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.98 179.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -83.68 -38.03 22.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.2 t -67.07 -37.21 83.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.187 0.518 . . . . 0.0 109.648 179.061 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.459 ' CG ' HG13 ' A' ' 14' ' ' ILE . 44.3 tp -66.98 -51.89 49.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.3 -24.3 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 178.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -72.44 -41.36 66.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.635 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -59.27 -46.93 87.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.532 179.696 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.463 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -61.54 -40.66 95.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -36.91 66.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.38 179.73 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.7 -51.42 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.31 179.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.63 -28.52 69.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.692 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.28 32.71 2.92 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.65 179.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.487 ' CD2' HD13 ' A' ' 62' ' ' LEU . 4.8 m-85 -100.71 156.48 17.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.56 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -85.3 94.54 8.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 p -80.03 155.54 27.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.919 -178.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -154.35 135.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.741 -178.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.2 t -112.91 111.01 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.127 179.918 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -105.21 121.6 44.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.013 0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.468 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 tp -84.6 110.51 18.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.979 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.592 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -93.85 166.4 12.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.248 178.464 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.57 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 11.0 t0 -57.04 66.51 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 124.38 -9.85 8.23 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.486 -0.864 . . . . 0.0 114.45 178.428 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.592 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 44.6 mt -144.66 154.12 42.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 117.707 0.753 . . . . 0.0 112.581 -179.395 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 24.0 m-85 -111.08 134.89 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.444 178.065 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.14 155.39 29.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 111.409 -179.547 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 26' ' ' LEU . 60.2 t -126.46 108.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.358 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -109.77 143.26 39.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.696 -179.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.47 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.6 pp -135.42 123.54 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.521 0.677 . . . . 0.0 111.746 179.799 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.4 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.77 104.18 0.26 Allowed Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.968 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.73 120.58 29.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.676 0.274 . . . . 0.0 110.32 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -139.17 171.36 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.033 0.444 . . . . 0.0 111.581 -179.114 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -80.97 -17.34 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.962 179.53 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.01 131.58 56.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.025 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.2 ttpt -57.8 -37.63 74.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -46.18 -32.77 3.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.041 0.448 . . . . 0.0 110.988 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 45.9 m-80 -71.83 -49.61 36.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.416 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -57.6 -44.18 85.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.206 179.581 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.79 -51.92 67.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.757 0.313 . . . . 0.0 111.192 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.59 -34.11 72.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.059 -179.871 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.487 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.92 -53.2 15.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.83 0.824 . . . . 0.0 110.138 179.561 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.485 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.75 -58.56 6.79 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.911 -178.041 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.37 -37.67 56.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.396 179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.0 ttt180 -64.64 -37.65 88.29 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.788 178.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.436 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.62 -42.29 91.71 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.721 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 20.7 mttt -61.53 -46.61 89.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.682 178.71 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -69.88 -25.32 63.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.445 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.6 -23.25 49.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.217 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.38 24.25 5.13 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.533 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.87 148.84 52.57 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.302 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.433 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 22.5 t0 -92.63 74.28 5.06 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.727 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.476 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -87.61 142.1 28.1 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.183 0.516 . . . . 0.0 111.705 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pp -134.72 153.57 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.801 178.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.416 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 79.6 t -101.12 136.53 32.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.946 0.403 . . . . 0.0 111.041 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.2 pt -136.42 135.75 49.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.39 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.427 HD12 ' CE1' ' A' ' 10' ' ' TYR . 14.8 tp -98.79 104.61 16.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.199 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -119.47 138.57 53.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.999 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.82 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.79 0.329 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -159.76 127.83 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.8 mtmm -163.08 97.87 0.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.824 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.3 t -159.01 105.34 1.75 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.871 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 m -97.31 87.73 4.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.46 31.41 5.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.09 163.94 13.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.992 179.899 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 165.8 157.98 10.44 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 1.2 mt -143.75 138.33 28.73 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.31 106.85 18.08 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.105 0.479 . . . . 0.0 110.085 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -126.78 154.18 44.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.446 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -109.28 135.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.141 179.701 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -127.68 138.14 52.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.542 0.21 . . . . 0.0 111.07 -179.356 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.518 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -108.16 -4.59 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.923 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.38 176.27 30.24 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 118.609 -1.758 . . . . 0.0 115.352 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.62 143.94 24.07 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.596 -0.802 . . . . 0.0 108.999 178.024 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -152.95 144.07 23.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.954 0.407 . . . . 0.0 111.635 -179.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.55 -17.29 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.187 179.761 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.28 127.57 62.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.284 0.564 . . . . 0.0 112.175 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tmtt? -70.16 -41.78 73.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.634 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.03 -35.51 47.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.301 0.572 . . . . 0.0 109.763 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -74.47 -32.8 62.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.221 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.72 -27.36 63.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.81 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.83 -37.32 55.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -34.31 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.196 0.522 . . . . 0.0 109.877 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.529 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 19.0 tp -69.73 -51.98 29.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.465 179.566 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.95 -26.41 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.0 110.663 179.227 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.2 m -73.95 -40.81 62.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.104 179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' ND2' ' N ' ' A' ' 30' ' ' ALA . 0.3 OUTLIER -60.3 -49.4 77.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.745 -179.926 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.553 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -60.85 -39.42 89.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.294 179.542 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.83 -36.21 64.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.2 179.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -50.13 68.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.268 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 2.1 mmtt -62.54 -28.61 69.97 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.731 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.54 33.56 2.87 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.609 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.512 ' CD2' HD11 ' A' ' 62' ' ' LEU . 6.7 m-85 -101.46 157.6 16.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 110.736 179.564 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.69 93.3 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.879 179.254 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.6 p -80.5 157.15 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.151 0.501 . . . . 0.0 111.136 -178.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.98 140.07 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.429 -178.768 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -118.5 116.61 51.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.565 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.42 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -107.22 121.59 44.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.616 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.459 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.5 tp -77.26 108.64 10.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.269 0.557 . . . . 0.0 111.046 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.545 ' O ' ' N ' ' A' ' 44' ' ' GLY . 3.3 tmmm? -91.1 165.48 13.49 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.86 179.49 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.478 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 50.4 t0 -61.24 66.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.808 0.337 . . . . 0.0 111.719 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.545 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 118.58 -11.15 12.45 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.808 -0.71 . . . . 0.0 113.535 179.333 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.499 ' O ' ' HB3' ' A' ' 42' ' ' LYS . 5.9 mt -138.7 148.32 43.82 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 117.464 0.632 . . . . 0.0 112.251 -179.234 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.474 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.3 m-85 -109.25 127.27 54.13 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.615 178.313 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -107.47 151.82 25.05 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.128 0.489 . . . . 0.0 111.496 -179.713 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.47 HG13 ' HG ' ' A' ' 26' ' ' LEU . 52.7 t -125.77 106.73 16.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.084 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 13.6 tt0 -105.66 141.08 37.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.437 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 1.7 pp -134.6 123.59 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.524 0.678 . . . . 0.0 111.392 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.422 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.59 108.73 0.29 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 114.798 -1.092 . . . . 0.0 113.14 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.56 124.11 26.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.508 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -143.2 175.76 9.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 111.599 -179.18 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -84.52 -18.81 34.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.02 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.38 129.52 55.99 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.888 0.375 . . . . 0.0 111.084 -179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtm? -56.49 -36.87 69.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.52 -179.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -50.69 -31.69 17.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.865 0.364 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.434 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 27.3 m-80 -71.34 -49.38 43.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.699 179.925 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.21 97.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.66 -52.05 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 110.835 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.9 m -55.45 -39.87 70.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.512 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -66.86 -50.37 62.72 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.737 0.779 . . . . 0.0 110.59 179.608 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.416 ' CB ' HG11 ' A' ' 12' ' ' VAL . . . -52.03 -62.04 1.88 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.382 -177.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.87 -35.2 61.29 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.939 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.1 ttt180 -63.67 -40.59 97.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.003 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.474 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.06 -40.97 95.51 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.741 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.9 mttm -61.67 -47.56 84.8 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.653 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -68.7 -25.87 65.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.79 178.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.455 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.35 -22.13 52.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.584 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.35 23.78 5.62 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.586 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.546 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.0 149.89 52.41 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.294 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.518 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 9.2 t0 -92.3 73.75 5.33 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.961 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -87.3 140.09 29.89 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.042 0.448 . . . . 0.0 111.887 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.1 pt -133.7 153.14 36.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.891 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 89.3 t -105.77 138.6 30.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.005 0.431 . . . . 0.0 110.97 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 pt -142.22 142.36 27.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.405 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.7 tp -91.69 107.83 19.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.211 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.01 103.7 16.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.018 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.32 -0.847 . . . . 0.0 111.034 179.794 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.8 ttmt -171.25 -42.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.11 117.35 2.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 t -155.65 141.02 17.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m -163.0 134.52 5.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.761 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -106.05 115.25 29.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.976 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.09 -175.93 3.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.964 -179.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.26 163.93 21.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.559 179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 26.2 mt -143.85 140.61 29.9 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.774 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.53 106.93 18.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.1 0.476 . . . . 0.0 110.017 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -127.98 155.32 44.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.443 179.57 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.481 HG12 ' CA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -108.45 137.82 38.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.364 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 60.9 tt0 -128.91 135.29 48.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.906 -179.436 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.509 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -107.79 -4.69 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -178.777 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.26 175.99 29.81 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.616 -1.754 . . . . 0.0 115.273 178.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.67 144.37 24.32 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.247 178.06 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.69 144.21 23.4 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.988 0.423 . . . . 0.0 111.51 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.91 -16.27 1.76 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.202 179.819 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -108.45 127.88 64.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 112.236 -179.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.448 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.3 ttpt -69.83 -42.03 74.16 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.636 179.588 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -35.28 49.53 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.183 0.515 . . . . 0.0 109.758 179.108 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -74.6 -33.08 62.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.303 178.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.76 -25.76 63.05 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.749 179.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.16 -36.63 47.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -66.48 -35.4 80.19 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.528 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 19.8 tp -69.02 -52.57 27.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.442 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.07 -25.96 47.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.482 . . . . 0.0 110.647 179.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.8 t -74.66 -40.4 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.544 ' ND2' ' N ' ' A' ' 30' ' ' ALA . 0.3 OUTLIER -60.64 -48.9 79.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.62 -179.883 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.544 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -61.16 -39.63 90.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.157 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.56 -36.1 63.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.279 179.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.67 -51.6 62.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.66 -28.72 70.11 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.746 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.03 34.82 2.47 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.662 178.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -101.83 159.07 15.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.911 0.386 . . . . 0.0 110.723 179.391 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.44 94.43 9.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.12 179.382 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 83.7 p -80.55 156.83 26.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.223 0.535 . . . . 0.0 110.965 -178.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -156.2 137.87 5.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.525 -178.706 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 19.6 t -116.22 114.43 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.567 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.414 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -107.1 122.25 46.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.58 179.665 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 tp -77.6 108.28 10.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.305 0.574 . . . . 0.0 111.175 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.548 ' O ' ' N ' ' A' ' 44' ' ' GLY . 3.7 tmmm? -90.76 165.48 13.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.913 179.444 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.478 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 35.6 t70 -61.27 66.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 111.661 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 119.64 -12.17 11.05 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.678 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.501 ' O ' ' HB3' ' A' ' 42' ' ' LYS . 4.9 mt -139.19 150.48 45.62 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 117.479 0.64 . . . . 0.0 112.452 -179.29 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.0 m-85 -109.75 128.06 55.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.518 178.282 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.484 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -107.79 151.7 25.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.183 0.516 . . . . 0.0 111.512 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.455 HG11 ' HG ' ' A' ' 26' ' ' LEU . 51.0 t -125.45 105.53 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.068 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 7.5 tt0 -104.3 141.54 36.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.444 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 1.7 pp -134.57 123.57 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.46 0.647 . . . . 0.0 111.593 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.422 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.37 107.38 0.23 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.208 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -131.96 123.46 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.34 175.16 9.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.176 0.512 . . . . 0.0 111.649 -179.224 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 p -83.43 -18.75 37.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.009 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.49 129.32 56.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.955 0.407 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -55.49 -35.9 66.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.258 -179.876 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -50.21 -32.62 16.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.453 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 9.5 m120 -70.79 -50.15 38.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.66 -44.72 93.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.169 179.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -57.57 -52.84 63.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 0.0 110.884 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.9 m -55.67 -38.94 70.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.908 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.506 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -67.02 -51.08 59.3 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.788 0.804 . . . . 0.0 110.475 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.481 ' CA ' HG12 ' A' ' 12' ' ' VAL . . . -53.24 -61.56 2.22 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.279 -177.573 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.81 -36.91 49.57 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -63.63 -39.54 94.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.859 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.459 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.94 -41.85 90.79 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.732 179.032 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.5 mttm -61.14 -48.27 82.39 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.18 -25.99 65.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.803 178.559 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.453 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -77.77 -21.04 52.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.497 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.34 24.21 5.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.518 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.548 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.35 149.81 52.4 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.162 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 46.3 t0 -92.8 73.61 4.92 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.965 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.459 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.85 139.28 31.41 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.06 0.457 . . . . 0.0 111.747 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.475 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.7 pt -132.82 149.76 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.161 179.089 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 98.4 t -101.88 137.22 30.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.93 0.395 . . . . 0.0 111.017 179.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.421 HD11 HG23 ' A' ' 76' ' ' ILE . 20.3 pt -138.49 139.12 41.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.237 -179.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.441 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.3 tp -96.83 107.97 20.56 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.244 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -135.07 132.97 38.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.893 -179.999 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.792 0.329 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.67 -179.36 6.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.872 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.04 -48.35 0.45 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.9 t -101.65 127.8 48.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.841 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.17 -44.1 2.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.917 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.7 t -89.85 123.07 33.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.84 128.18 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.18 143.87 47.92 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.493 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 18.0 mt -143.86 138.96 29.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.512 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -100.93 106.77 18.13 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.117 0.484 . . . . 0.0 110.058 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.98 154.78 42.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.591 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.498 HG11 ' CA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -108.48 138.84 33.32 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.151 179.706 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 6.7 tt0 -131.35 135.43 47.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.684 0.278 . . . . 0.0 110.985 -179.211 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.479 HG13 ' CG ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -107.45 -5.41 10.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.85 175.68 30.05 Favored Glycine 0 C--N 1.338 0.664 0 C-N-CA 118.772 -1.68 . . . . 0.0 115.285 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.61 142.95 23.41 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.046 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -153.06 144.17 23.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.015 0.436 . . . . 0.0 111.625 -179.348 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.512 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.4 OUTLIER -53.93 -16.16 1.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.02 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.03 126.7 64.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 3.9 ttpt -69.39 -41.28 76.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.381 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.87 -34.28 53.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.249 0.547 . . . . 0.0 109.647 179.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.74 -33.09 62.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.161 178.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.9 -18.64 60.88 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.016 179.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.92 -38.62 20.83 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.67 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -67.52 -37.54 82.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.284 0.564 . . . . 0.0 109.524 178.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CG ' HG13 ' A' ' 14' ' ' ILE . 54.3 tp -65.67 -51.91 55.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.992 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.06 -24.21 62.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.611 179.238 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.41 -40.55 70.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.28 179.45 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.49 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -60.76 -48.44 81.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.659 179.787 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.49 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -58.53 -42.81 88.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.519 -179.871 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -55.12 -37.23 66.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.151 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.13 -51.25 64.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.361 179.395 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 14.6 mmtt -62.64 -28.86 70.21 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.67 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.22 33.56 2.51 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.752 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CD2' HD12 ' A' ' 62' ' ' LEU . 5.2 m-85 -104.22 164.22 11.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.594 179.379 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.55 92.52 8.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.939 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 m -81.22 127.37 32.61 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.288 0.566 . . . . 0.0 111.178 -178.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -124.61 139.04 52.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.671 -179.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.9 t -116.04 113.11 42.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.196 179.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.424 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -106.4 122.23 45.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.809 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.457 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 tp -77.37 108.03 10.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.144 0.497 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 44' ' ' GLY . 4.3 tmmm? -90.59 165.39 13.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.821 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.475 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.4 t0 -60.62 66.28 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.774 -179.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 121.6 -16.75 8.98 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.667 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.512 ' HA ' ' HA ' ' A' ' 18' ' ' LYS . 4.2 mt -136.66 152.81 50.82 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 117.495 0.648 . . . . 0.0 112.425 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.488 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.8 m-85 -109.75 129.28 55.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.544 178.201 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -109.76 151.78 26.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.42 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.413 HG23 ' HB3' ' A' ' 26' ' ' LEU . 67.5 t -124.03 105.41 15.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.011 179.792 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 8.4 tt0 -104.63 141.44 36.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.516 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.456 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.6 pp -135.48 123.1 36.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.431 0.634 . . . . 0.0 111.668 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.428 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 81.39 108.13 0.35 Allowed Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.945 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.48 122.27 27.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.519 0.199 . . . . 0.0 110.468 179.586 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.47 172.64 12.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.47 . . . . 0.0 111.518 -179.295 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 t -82.87 -16.81 46.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.059 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.83 129.9 56.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.512 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.0 tmtt? -56.77 -35.31 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.264 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -50.32 -32.97 18.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 110.928 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.441 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 24.4 m-80 -70.71 -49.59 45.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.725 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.46 -42.93 93.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.117 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -58.84 -52.15 66.97 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.106 -179.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -35.79 72.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.921 -179.93 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.49 -51.51 35.28 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 121.757 0.789 . . . . 0.0 110.188 179.561 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.498 ' CA ' HG11 ' A' ' 12' ' ' VAL . . . -54.62 -60.62 3.1 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.064 -177.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.85 51.55 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.663 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -63.1 -38.16 90.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.814 178.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.68 -41.99 91.78 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.723 179.085 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 43.4 mttm -61.39 -47.59 85.13 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.621 178.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -68.91 -25.44 64.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.69 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.43 -21.96 52.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.392 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.78 24.2 5.63 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.375 -179.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.78 149.09 52.58 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -179.214 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.6 t70 -92.25 71.89 5.33 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.695 179.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.466 ' CB ' ' CB ' ' A' ' 66' ' ' ALA . . . -85.25 141.39 30.14 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-O 121.09 0.471 . . . . 0.0 111.731 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.08 152.62 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 94.0 t -104.73 135.19 43.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.875 0.369 . . . . 0.0 110.953 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt -137.7 140.57 41.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.36 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.3 tp -94.74 106.07 18.04 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.19 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -94.17 111.0 22.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 -179.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.901 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.8 mt . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.873 0.368 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -106.72 106.06 16.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.844 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -100.39 31.93 3.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 78.0 p -75.26 168.69 19.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.2 p -116.6 38.41 3.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.6 t -108.19 135.97 48.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.882 179.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.6 m -76.31 169.52 18.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.981 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.2 26.74 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.636 179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 81.7 mt -143.86 141.25 30.23 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.523 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.8 m-85 -101.25 107.28 18.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.109 0.48 . . . . 0.0 109.974 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.3 mttm -126.08 155.37 41.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.4 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 74' ' ' ILE . 0.1 OUTLIER -109.07 137.49 40.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.212 179.811 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tt0 -128.44 133.4 48.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.675 0.274 . . . . 0.0 111.409 -179.357 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.574 ' HA ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -98.6 -5.61 9.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.13 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 151.31 -176.49 29.75 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 119.037 -1.554 . . . . 0.0 114.813 178.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -152.35 144.41 23.81 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.929 -0.636 . . . . 0.0 109.428 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -153.22 141.89 20.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.914 0.388 . . . . 0.0 111.532 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.502 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.22 -15.57 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.892 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.35 123.31 62.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.076 0.465 . . . . 0.0 112.165 -179.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -67.19 -41.03 86.55 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.23 179.262 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.43 -31.89 47.33 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.205 0.526 . . . . 0.0 109.704 178.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -76.42 -32.38 58.44 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.263 178.336 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.21 -17.25 58.64 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.095 179.086 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -84.47 -38.68 19.84 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.339 0.59 . . . . 0.0 109.719 178.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.516 ' CD1' HG13 ' A' ' 14' ' ' ILE . 12.0 tp -66.86 -56.89 8.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.482 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -33.66 66.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.149 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 m -61.27 -40.88 95.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.41 179.614 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.55 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.5 OUTLIER -61.38 -43.38 98.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.45 179.655 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.55 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -61.39 -41.98 98.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.11 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -55.04 -35.99 65.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.137 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.4 -51.48 64.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.277 179.371 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 8.5 mmtt -62.63 -28.55 69.98 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.9 33.46 2.6 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.3 -0.863 . . . . 0.0 112.775 178.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.503 ' CD2' HD13 ' A' ' 62' ' ' LEU . 4.6 m-85 -102.37 158.92 15.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.917 0.389 . . . . 0.0 110.904 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.56 92.72 8.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.738 179.22 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.418 ' HA ' HG21 ' A' ' 50' ' ' ILE . 16.1 p -80.69 158.52 25.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.191 0.519 . . . . 0.0 111.339 -178.642 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.82 141.71 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.479 -178.818 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 23.6 t -118.84 115.84 49.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.513 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.416 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -108.68 123.68 49.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.455 179.585 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.457 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.9 tp -78.07 108.8 11.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.551 ' O ' ' N ' ' A' ' 44' ' ' GLY . 4.0 tmmm? -91.17 165.61 13.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.901 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.487 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 6.4 t0 -61.17 65.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.854 0.359 . . . . 0.0 111.795 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 121.21 -15.72 9.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.787 -0.72 . . . . 0.0 113.579 179.307 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.514 ' O ' ' HB3' ' A' ' 42' ' ' LYS . 4.0 mt -136.27 149.71 48.6 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 117.423 0.612 . . . . 0.0 112.496 -179.234 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.9 m-85 -108.31 126.53 52.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.284 178.316 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -106.74 148.94 27.83 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.238 0.542 . . . . 0.0 111.752 -179.362 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.431 HG11 ' HG ' ' A' ' 26' ' ' LEU . 61.9 t -120.31 106.17 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.919 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 13' ' ' GLN . 14.3 tt0 -105.57 139.89 39.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.001 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.456 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 1.7 pp -135.88 124.03 36.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.459 0.647 . . . . 0.0 111.64 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.21 108.99 0.28 Allowed Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.197 179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -133.12 115.49 15.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.682 0.277 . . . . 0.0 110.425 179.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.55 175.93 8.99 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.057 0.456 . . . . 0.0 111.564 -179.256 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 p -84.56 -18.29 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.023 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.43 128.71 56.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.865 0.364 . . . . 0.0 111.105 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.5 tmtm? -55.59 -36.42 66.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.259 -179.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -51.65 -32.01 27.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.429 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 4.1 m120 -70.67 -49.5 46.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.418 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -59.77 -41.66 91.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.082 179.656 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -59.14 -51.5 69.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.994 -179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -36.71 71.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.832 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.503 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.46 -50.64 43.58 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.667 0.746 . . . . 0.0 110.15 179.543 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.446 ' CB ' HG13 ' A' ' 12' ' ' VAL . . . -53.44 -60.57 3.14 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.06 -177.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.66 -37.42 58.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.709 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -63.82 -38.51 91.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 0.0 109.804 179.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.455 ' CB ' ' HB2' ' A' ' 73' ' ' ALA . . . -65.3 -41.75 93.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.759 179.114 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.1 OUTLIER -62.0 -46.5 88.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.614 178.841 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.88 -25.79 64.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.642 178.253 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.451 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -76.85 -21.95 54.26 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.266 179.608 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.01 24.12 5.87 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.936 -0.649 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 0.9 OUTLIER -130.56 152.14 50.26 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.139 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.574 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 17.9 t70 -94.47 71.35 3.71 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.949 -0.301 . . . . 0.0 111.199 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.466 ' HB2' ' CG2' ' A' ' 14' ' ' ILE . . . -88.81 140.5 29.38 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 121.062 0.458 . . . . 0.0 111.667 179.654 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 13.7 pt -134.21 157.66 41.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.837 179.259 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.418 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 97.1 t -105.23 137.24 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.918 0.389 . . . . 0.0 111.158 179.888 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.5 pt -141.45 142.37 29.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.393 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.4 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.0 tp -93.72 107.24 19.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.241 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -104.38 136.84 43.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.095 -179.623 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.4 p . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.882 179.826 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.875 0.369 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -169.92 95.1 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.914 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -69.11 0.3 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.5 m 60.85 101.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 179.963 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.38 -70.35 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.941 -179.948 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.1 p -177.74 175.81 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.903 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -50.03 8.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -123.45 -145.01 6.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.374 -179.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 14.7 mt -144.01 140.66 29.7 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.7 m-85 -101.4 106.8 17.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.011 0.434 . . . . 0.0 109.86 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.83 153.5 46.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.495 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.499 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.82 139.26 27.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.388 -179.942 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -130.42 137.52 49.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.586 0.232 . . . . 0.0 111.222 -179.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.467 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.92 -6.23 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.89 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.59 175.02 30.08 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 118.713 -1.708 . . . . 0.0 115.355 178.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.44 145.37 25.18 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.554 -0.823 . . . . 0.0 109.031 178.141 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -153.28 148.22 26.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 111.611 -179.188 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 1.7 tttt -55.61 -17.23 5.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.732 179.703 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.6 t -108.65 129.88 62.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.019 0.438 . . . . 0.0 111.948 -179.487 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -73.74 -37.68 65.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.312 179.612 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.43 64.23 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.297 0.57 . . . . 0.0 109.527 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -72.99 -32.15 64.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.986 178.107 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.4 -20.0 60.85 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.805 179.055 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -82.11 -37.33 26.46 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.726 179.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.5 t -69.35 -35.93 76.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.796 179.037 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.458 ' CG ' HG13 ' A' ' 14' ' ' ILE . 50.9 tp -66.39 -51.75 53.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.358 179.393 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.75 -27.85 65.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.097 0.475 . . . . 0.0 110.417 179.072 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 t -67.7 -41.58 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.599 179.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.6 OUTLIER -60.06 -47.63 85.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.622 179.651 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.501 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.64 -41.77 95.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.525 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -54.54 -36.36 64.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.244 179.587 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.41 -51.4 65.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.429 179.472 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.9 mmtt -62.67 -28.81 70.18 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.678 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.01 34.63 2.52 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.636 178.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.505 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -102.66 159.44 15.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.899 0.381 . . . . 0.0 110.802 179.631 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -87.6 93.82 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.252 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.579 ' HA ' HG21 ' A' ' 50' ' ' ILE . 41.2 p -79.02 152.87 30.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.973 -178.957 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.29 135.0 6.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.525 -178.706 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 12.0 t -111.87 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.32 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.442 ' HG ' ' CD ' ' A' ' 47' ' ' LYS . 0.4 OUTLIER -110.19 125.16 52.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.674 179.737 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.0 tp -78.01 102.97 7.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.34 0.591 . . . . 0.0 111.191 -179.918 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.684 ' HB2' ' CE ' ' A' ' 47' ' ' LYS . 1.2 tmmm? -91.28 120.41 32.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.002 179.019 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.448 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . 38.8 t70 47.11 -84.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.765 0.317 . . . . 0.0 110.822 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.564 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -132.38 -0.53 4.53 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.222 178.911 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' LYS . 2.0 mt -110.42 167.0 10.54 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 110.736 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 25.5 m-85 -119.09 137.79 53.33 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.704 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.684 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -116.27 154.08 30.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.983 0.42 . . . . 0.0 111.067 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.454 HG22 ' HB3' ' A' ' 26' ' ' LEU . 91.7 t -122.95 117.51 52.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.976 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -119.15 143.99 46.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.344 -179.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.579 HG21 ' HA ' ' A' ' 37' ' ' SER . 0.4 OUTLIER -137.28 140.87 41.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.971 178.993 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.45 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 69.38 97.14 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.971 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.89 112.52 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -135.89 171.05 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 111.633 -178.802 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -79.44 -16.42 56.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.767 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.01 132.14 56.69 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.913 0.387 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.8 ttpt -58.48 -36.74 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -46.71 -32.76 3.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.458 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 5.5 m120 -71.75 -50.08 33.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.2 -43.31 82.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.02 179.523 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.58 -51.17 71.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.431 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -57.93 -38.57 76.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.848 179.957 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.505 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -67.82 -52.23 39.34 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.727 0.775 . . . . 0.0 110.395 179.509 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.492 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.04 -60.73 2.91 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.18 -177.808 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.95 -36.39 49.14 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.467 179.48 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.54 -39.89 92.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.047 179.035 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.46 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.82 -41.52 95.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.591 179.113 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.4 mttm -61.87 -47.31 85.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.661 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -69.43 -25.12 63.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.703 178.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' CE2' ' A' ' 71' ' ' PHE . . . -77.63 -22.11 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.299 179.85 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.33 23.09 5.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.843 -0.694 . . . . 0.0 111.418 -179.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.547 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.14 148.14 51.95 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -179.248 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -91.8 74.43 5.73 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.772 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.81 140.92 29.22 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.129 0.49 . . . . 0.0 111.855 179.981 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.9 pp -133.49 151.46 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.957 179.196 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 96.7 t -101.54 136.22 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.846 0.355 . . . . 0.0 110.955 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.95 139.16 40.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.244 -179.869 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.7 tp -94.19 107.61 19.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.31 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -94.45 121.37 35.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.185 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.914 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 61.88 179.41 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -83.48 129.63 34.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.99 179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.5 t 43.49 73.46 0.14 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.26 36.41 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.81 120.9 21.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.7 p -71.04 -168.9 0.32 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.977 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -105.22 -145.95 14.17 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.524 179.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.0 mt -143.5 139.16 29.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.798 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.5 m-85 -101.28 106.01 17.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.115 0.483 . . . . 0.0 110.163 179.681 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.46 153.38 43.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.359 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.512 HG13 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.55 141.55 20.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.379 179.84 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -133.73 132.74 40.95 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.728 0.299 . . . . 0.0 111.243 -178.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.475 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.08 -5.9 10.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.057 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.96 173.02 29.06 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 118.951 -1.595 . . . . 0.0 114.778 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.499 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.03 137.26 18.42 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 114.986 -0.607 . . . . 0.0 109.625 178.45 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -146.29 150.54 35.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.873 0.368 . . . . 0.0 111.102 -179.62 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 30.6 ttmt -61.31 -12.91 15.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.937 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.36 129.46 62.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.011 0.434 . . . . 0.0 111.965 -179.402 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 ttpt -71.4 -40.1 70.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.579 179.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.15 -33.62 58.42 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -76.48 -32.03 58.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.354 178.349 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.6 60.25 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.999 179.271 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.91 -38.47 21.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.693 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -67.34 -36.71 81.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 109.696 179.104 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.464 ' CG ' HG13 ' A' ' 14' ' ' ILE . 50.9 tp -67.2 -51.57 51.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.253 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.57 -24.4 60.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.369 178.917 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -41.66 67.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.559 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 30' ' ' ALA . 0.8 OUTLIER -59.13 -47.06 86.67 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.391 179.816 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.461 ' N ' ' OD1' ' A' ' 29' ' ' ASN . . . -60.74 -40.76 93.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.668 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -55.13 -36.91 66.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.203 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -51.35 62.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.24 179.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.48 -28.6 69.94 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.673 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.06 32.35 3.07 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.542 179.111 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.523 ' CZ ' ' HB3' ' A' ' 33' ' ' LYS . 6.1 m-85 -100.5 156.77 17.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.897 0.38 . . . . 0.0 110.776 179.506 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.27 93.63 8.73 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.66 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 54.1 p -80.16 156.76 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.076 0.465 . . . . 0.0 111.107 -178.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -157.13 139.13 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.716 -178.641 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 24.0 t -113.75 110.72 33.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.18 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -105.51 122.95 47.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.008 0.432 . . . . 0.0 110.663 179.798 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tp -86.76 111.62 20.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.089 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.674 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -92.38 166.18 12.7 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.358 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.487 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 3.9 t70 -57.87 67.35 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . 134.03 -21.78 3.88 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.64 178.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.674 ' HG ' ' HE2' ' A' ' 42' ' ' LYS . 36.9 mt -143.37 166.38 24.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 117.865 0.832 . . . . 0.0 112.504 -179.055 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 41' ' ' LEU . 26.1 m-85 -114.79 138.75 50.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.565 178.402 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.49 157.18 29.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.031 0.443 . . . . 0.0 111.338 -179.836 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 85.5 t -124.67 110.99 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.407 -179.701 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -110.24 141.01 43.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.422 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.505 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.11 123.1 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.45 0.643 . . . . 0.0 111.652 179.702 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.414 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 80.13 100.13 0.3 Allowed Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.9 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.25 123.18 40.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.369 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -142.8 170.25 16.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.122 0.486 . . . . 0.0 111.501 -179.112 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.5 p -80.47 -16.4 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.903 179.537 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.55 131.05 56.79 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.893 0.378 . . . . 0.0 110.95 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 19.5 ttpp -57.52 -36.74 71.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.404 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -46.43 -32.17 3.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.977 0.418 . . . . 0.0 110.917 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.452 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 7.9 m120 -73.79 -48.7 29.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.356 179.647 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.78 -45.62 91.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.132 179.653 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -59.07 -53.07 62.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.702 0.287 . . . . 0.0 111.22 -179.649 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 14.8 t -58.87 -34.4 71.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.938 0.399 . . . . 0.0 111.034 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.488 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.85 -52.95 20.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.87 0.843 . . . . 0.0 110.195 179.522 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.512 ' HA ' HG13 ' A' ' 12' ' ' VAL . . . -53.73 -58.49 7.01 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.97 -177.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.96 -37.28 60.99 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.468 179.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.2 ttt180 -64.16 -39.06 93.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.764 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.45 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.03 -40.44 96.33 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.45 179.075 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.02 91.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.556 178.741 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -70.25 -25.51 63.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.878 178.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.47 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.17 -22.96 51.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.374 179.784 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.31 23.67 5.38 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.547 -179.313 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.22 148.28 52.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 -179.245 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.3 t0 -92.31 73.72 5.32 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.779 179.594 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.475 ' HB1' ' CG2' ' A' ' 14' ' ' ILE . . . -84.96 142.86 29.34 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.082 0.468 . . . . 0.0 111.806 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.2 pt -134.66 153.06 34.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.1 t -103.75 135.38 41.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 111.073 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt -134.94 135.72 52.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.225 -179.909 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 15.3 tp -99.76 104.19 15.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.037 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -99.88 132.0 45.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.922 0.392 . . . . 0.0 111.201 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.9 p . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.847 179.921 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.836 0.35 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -135.11 143.53 46.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.956 179.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttp 60.09 90.52 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.8 m -129.06 154.48 46.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.889 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -134.88 -46.7 0.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.917 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.3 106.11 18.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.886 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 t -164.17 -176.86 4.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -170.79 167.1 40.28 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.629 -179.984 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.7 mt -143.92 141.69 30.38 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 179.73 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.3 m-85 -101.76 106.97 18.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.163 0.506 . . . . 0.0 109.937 179.582 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -125.93 152.88 45.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.349 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.518 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -104.23 142.57 17.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.171 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -135.51 134.19 39.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.853 0.359 . . . . 0.0 111.423 -178.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.475 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.23 -5.65 10.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -179.328 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.78 173.97 27.88 Favored Glycine 0 C--N 1.338 0.672 0 C-N-CA 119.215 -1.469 . . . . 0.0 114.421 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.65 147.95 27.36 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.092 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -152.22 151.64 31.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 111.268 -179.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 6.2 pttp -60.89 -14.36 21.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.345 179.521 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.93 128.43 61.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.955 0.407 . . . . 0.0 111.76 -179.75 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.407 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.8 -36.86 70.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.247 179.639 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.16 -32.6 70.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 109.779 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -76.98 -34.33 57.56 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.109 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.54 -19.39 61.52 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.659 178.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -83.73 -38.29 21.57 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.345 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.0 t -65.28 -37.03 85.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.309 0.576 . . . . 0.0 109.644 178.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.548 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 40.3 tp -67.91 -48.7 65.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.137 179.172 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.35 -26.22 60.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.143 0.497 . . . . 0.0 110.369 178.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.24 -40.45 62.39 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.07 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.548 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.32 -48.55 81.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.939 0.4 . . . . 0.0 110.633 -179.977 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.515 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.46 -38.35 89.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.84 -36.64 65.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.416 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.71 -51.42 60.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.524 179.546 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.482 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.34 -28.04 69.48 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.804 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.28 33.63 2.91 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.491 179.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.0 157.96 16.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.687 179.356 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.37 95.92 9.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.144 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 54.7 p -80.36 155.2 27.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.17 0.51 . . . . 0.0 110.973 -178.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -155.66 139.96 8.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.783 -178.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.586 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.34 116.4 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.497 -179.712 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.425 HD13 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -119.18 130.12 55.34 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.904 0.383 . . . . 0.0 110.337 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.425 ' N ' HD13 ' A' ' 40' ' ' LEU . 8.5 tp -90.79 115.02 27.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.01 -179.498 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.712 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.6 OUTLIER -106.16 151.94 24.09 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.372 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.442 ' C ' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 30.85 -82.11 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 O-C-N 123.206 0.316 . . . . 0.0 111.154 -179.804 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.669 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -145.75 25.47 1.8 Allowed Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.288 -0.482 . . . . 0.0 111.923 178.948 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.712 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 16.1 mt -132.02 161.54 32.93 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.989 0.424 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.43 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 27.4 m-85 -115.51 135.94 53.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.252 178.918 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.586 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.71 148.42 30.48 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 120.996 0.427 . . . . 0.0 111.114 -179.912 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.424 HG13 HD12 ' A' ' 14' ' ' ILE . 58.0 t -120.03 99.08 6.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.648 179.606 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -102.56 140.84 36.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.701 -179.62 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.512 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -134.01 123.05 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 111.324 179.623 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.434 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 78.28 103.56 0.2 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.819 179.897 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.43 124.41 41.4 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.35 174.38 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.088 0.471 . . . . 0.0 111.606 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.17 -17.27 43.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.984 179.721 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.6 t -112.6 128.73 56.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtt? -56.68 -34.69 67.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.225 -179.881 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.51 -32.66 28.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.853 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.434 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 79.7 m-20 -70.49 -49.52 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.65 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.411 ' HB1' ' CG1' ' A' ' 75' ' ' VAL . . . -59.2 -41.56 88.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.91 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.95 -51.15 70.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.8 0.333 . . . . 0.0 110.804 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.0 m -58.66 -35.89 73.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 -180.0 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD11 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.07 -51.56 30.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.766 0.793 . . . . 0.0 110.161 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.518 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -53.65 -58.49 7.01 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.938 -177.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -36.76 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.02 -38.87 92.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.559 178.937 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.468 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.18 -40.75 94.67 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.476 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.9 mttm -62.07 -47.21 85.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.624 178.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -68.68 -25.89 65.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.66 178.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.459 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.11 -21.94 53.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.394 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.07 23.45 5.82 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.409 -179.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.86 148.55 52.64 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.354 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -92.21 74.52 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.475 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.08 142.29 28.81 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.082 0.468 . . . . 0.0 112.003 179.89 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 10.1 pt -135.53 153.09 32.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.062 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.411 ' CG1' ' HB1' ' A' ' 59' ' ' ALA . 98.3 t -103.04 135.94 38.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.903 0.382 . . . . 0.0 110.914 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.415 HG23 HD11 ' A' ' 76' ' ' ILE . 10.2 tt -138.8 139.9 39.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.153 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 13.6 tp -94.59 105.82 17.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.138 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -99.13 125.0 44.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.172 -179.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.959 179.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.744 0.307 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -90.2 -59.39 2.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.802 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -121.2 165.28 15.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.7 175.27 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.863 179.917 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 106.94 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.2 m -128.24 23.43 6.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.133 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.1 m 54.32 -179.04 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.927 0.394 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -117.9 -143.39 7.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.377 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 22.6 mt -144.11 139.74 29.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.491 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -101.04 106.73 18.04 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.423 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -126.51 155.85 41.69 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.532 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.482 HG11 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -107.68 138.28 34.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.29 179.845 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -130.49 134.98 47.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.767 0.318 . . . . 0.0 111.104 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.481 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.27 -5.25 10.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.145 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.62 171.15 28.45 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 119.15 -1.5 . . . . 0.0 114.687 179.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.413 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -150.62 140.95 22.33 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.476 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -149.85 149.62 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.0 111.361 -179.323 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.14 -15.41 23.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.525 179.843 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -104.93 128.66 58.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.041 0.448 . . . . 0.0 111.765 -179.711 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.84 -38.92 70.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.452 179.772 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -32.39 65.24 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.168 0.509 . . . . 0.0 109.85 179.153 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.68 -33.86 53.15 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.25 178.511 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.8 -22.48 61.57 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.806 179.116 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -81.66 -38.83 25.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -64.0 -37.54 87.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.319 0.58 . . . . 0.0 109.72 179.021 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 27.5 tp -67.62 -46.33 72.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.206 179.357 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.49 -26.35 65.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.119 0.485 . . . . 0.0 110.631 179.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -74.82 -40.62 60.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.071 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.542 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.72 -48.58 81.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.911 0.386 . . . . 0.0 110.747 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.521 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.61 -38.3 89.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.333 179.472 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -55.18 -36.61 66.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.481 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.5 -50.29 65.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.388 179.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.488 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 6.1 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.709 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 32.65 3.1 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.554 179.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD13 ' A' ' 62' ' ' LEU . 6.2 m-85 -100.89 156.8 17.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.93 0.395 . . . . 0.0 110.72 179.639 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.52 94.19 8.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.009 179.422 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 86.3 p -80.24 155.98 27.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.114 0.483 . . . . 0.0 110.968 -178.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -158.22 142.33 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.761 -178.525 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.603 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 35.4 t -120.21 117.86 54.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.366 -179.759 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.417 ' CD1' ' C ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -118.5 133.95 55.47 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.981 0.42 . . . . 0.0 110.572 179.681 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.425 HD13 ' CD1' ' A' ' 46' ' ' TYR . 15.0 tp -93.81 115.54 27.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.676 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.5 OUTLIER -102.69 161.22 13.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.476 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.616 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 16.7 -82.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.818 0.342 . . . . 0.0 111.159 -179.492 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -141.21 26.31 2.46 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.004 178.569 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.676 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 19.7 mt -130.61 156.86 44.16 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.016 0.436 . . . . 0.0 111.429 -179.83 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 31.0 m-85 -113.02 132.7 55.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.324 178.99 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.603 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.48 149.45 27.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.983 0.421 . . . . 0.0 111.528 -179.85 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.473 HG13 HD12 ' A' ' 14' ' ' ILE . 85.9 t -121.81 100.97 9.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.29 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -106.84 141.9 37.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.543 -178.831 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.454 HG12 ' CD1' ' A' ' 14' ' ' ILE . 1.8 pp -134.78 123.48 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-O 121.469 0.652 . . . . 0.0 111.414 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 79.69 105.33 0.25 Allowed Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.004 179.671 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.44 115.49 18.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.628 0.252 . . . . 0.0 110.429 179.525 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.56 171.04 14.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.045 0.45 . . . . 0.0 111.544 -179.328 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.99 -18.33 50.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.02 133.05 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.934 0.397 . . . . 0.0 111.089 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.491 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 7.7 ttpt -58.82 -38.27 78.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.443 -179.708 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.01 -32.23 2.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.998 0.427 . . . . 0.0 110.839 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.432 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 65.3 m-80 -72.52 -49.23 34.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.413 179.638 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.97 -44.66 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.255 179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -59.17 -50.78 72.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 4.6 m -58.9 -36.23 74.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.793 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -69.34 -51.69 34.48 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.808 0.813 . . . . 0.0 110.293 179.446 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.482 ' HA ' HG11 ' A' ' 12' ' ' VAL . . . -54.1 -59.25 4.9 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.039 -177.983 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.41 -36.17 53.55 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.37 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.6 ttt180 -65.29 -38.95 91.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.727 178.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.449 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -65.72 -41.69 91.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.645 178.965 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.87 87.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.165 0.507 . . . . 0.0 109.662 178.773 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -69.34 -25.77 64.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.753 178.534 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.463 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.9 -22.65 53.08 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.91 23.9 5.41 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.481 -179.303 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.81 148.73 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.325 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.3 t0 -92.54 75.41 5.11 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.936 179.965 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.481 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -86.55 141.4 29.07 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 121.228 0.537 . . . . 0.0 111.931 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.6 pt -133.68 151.02 32.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.984 179.122 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 92.2 t -101.33 137.88 27.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.938 0.399 . . . . 0.0 111.03 -179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 pt -138.71 136.89 43.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.179 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.8 tp -102.97 106.69 17.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.41 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -104.43 131.02 52.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.94 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.854 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.83 0.347 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -135.42 -46.88 0.69 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.967 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.2 86.64 3.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.921 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 t -134.04 111.37 10.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.911 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -120.98 143.92 48.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.867 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.88 -26.68 12.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.962 179.965 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t 66.51 47.13 1.73 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.912 179.932 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -98.8 -163.75 30.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.305 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt -144.21 139.62 28.81 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.878 0.371 . . . . 0.0 110.348 179.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.7 m-85 -101.69 106.25 17.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.838 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -125.11 152.32 44.55 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.473 179.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.48 HG12 ' HA ' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -105.17 139.87 24.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.197 179.712 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -132.61 134.56 45.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.792 0.33 . . . . 0.0 111.282 -179.135 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.77 -5.74 10.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.234 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.13 172.62 27.6 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 119.18 -1.486 . . . . 0.0 114.707 178.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.416 ' CB ' ' HG3' ' A' ' 47' ' ' LYS . . . -151.54 147.95 27.42 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.025 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -152.21 153.11 33.16 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.485 -179.293 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.404 ' CG ' HD23 ' A' ' 45' ' ' LEU . 3.6 mtpp -59.8 -17.29 34.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.295 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.04 130.63 57.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.046 0.45 . . . . 0.0 111.915 -179.394 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -72.92 -38.21 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.231 179.515 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.18 66.24 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -75.46 -33.61 60.86 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.099 178.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.33 -20.81 61.42 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.649 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.4 -37.48 25.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.47 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.5 t -66.19 -37.23 85.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.772 179.085 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' O ' ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.19 -47.06 68.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.259 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.87 -26.07 65.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.055 0.455 . . . . 0.0 110.349 178.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.54 61.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.091 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.542 ' OD1' ' O ' ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.64 -48.34 82.05 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 120.863 0.363 . . . . 0.0 110.616 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.517 ' N ' ' ND2' ' A' ' 29' ' ' ASN . . . -62.58 -38.33 89.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.243 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -54.74 -36.61 64.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.387 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.67 -51.22 61.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.472 179.483 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.45 -28.2 69.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.73 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.44 33.24 2.97 Favored Glycine 0 N--CA 1.444 -0.775 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.44 179.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.498 ' CD2' HD13 ' A' ' 62' ' ' LEU . 5.9 m-85 -100.47 156.93 17.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.917 0.389 . . . . 0.0 110.628 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.96 95.21 8.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.935 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 51.5 p -80.14 155.01 27.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.174 0.512 . . . . 0.0 110.88 -178.801 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -155.55 139.34 8.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 -178.47 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.3 t -117.13 116.04 50.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.505 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -117.26 128.17 54.81 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.875 0.369 . . . . 0.0 110.436 179.815 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.429 HD23 ' CZ ' ' A' ' 46' ' ' TYR . 7.3 tp -90.75 116.76 28.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.891 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.635 ' O ' ' N ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -109.64 145.96 35.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.54 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 36.79 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 O-C-N 123.169 0.293 . . . . 0.0 110.562 -178.953 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.635 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -140.12 8.9 2.99 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.419 178.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.557 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 13.4 mt -114.13 159.37 20.14 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 111.399 179.833 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 m-85 -115.56 135.84 53.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.848 178.797 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.605 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -108.22 148.97 29.19 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 111.266 -179.749 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.431 HG23 ' HB3' ' A' ' 26' ' ' LEU . 58.9 t -121.62 99.41 7.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.579 179.666 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HG2' ' N ' ' A' ' 50' ' ' ILE . 2.4 tt0 -104.02 142.25 34.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.907 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 1.7 pp -135.39 123.25 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.623 0.725 . . . . 0.0 111.281 179.423 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.429 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 79.13 101.62 0.23 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.768 -1.106 . . . . 0.0 112.888 179.726 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.99 116.42 22.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.664 0.269 . . . . 0.0 110.399 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.29 171.09 14.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.084 0.469 . . . . 0.0 111.637 -179.209 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.4 p -80.43 -17.86 50.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.956 179.556 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -113.41 131.75 55.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.947 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 14.7 ttpt -57.64 -39.35 76.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.488 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -45.88 -32.1 2.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.02 0.438 . . . . 0.0 110.927 -179.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.446 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 73.2 m-80 -72.15 -49.41 36.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.308 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.49 -43.86 84.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.066 179.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.11 -49.81 76.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.872 0.368 . . . . 0.0 110.933 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.442 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.8 m -59.46 -36.06 75.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD13 ' CD2' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -70.0 -52.74 21.71 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 121.792 0.806 . . . . 0.0 110.282 179.479 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.48 ' HA ' HG12 ' A' ' 12' ' ' VAL . . . -53.98 -58.22 8.12 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.982 -177.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.89 -37.0 60.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.348 179.361 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.74 -39.79 94.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.715 179.016 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.456 ' CB ' ' CB ' ' A' ' 73' ' ' ALA . . . -64.69 -40.93 96.23 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.572 179.009 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.3 OUTLIER -62.13 -46.99 86.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.562 178.834 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -69.44 -25.57 64.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.791 178.618 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.82 -22.6 53.37 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.459 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 23.49 5.66 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 -179.325 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.66 148.4 52.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.386 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.6 t70 -91.98 74.65 5.59 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.465 ' HB3' ' CG2' ' A' ' 14' ' ' ILE . . . -85.79 140.39 30.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.085 0.469 . . . . 0.0 111.88 179.962 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.4 pt -132.66 151.97 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.925 179.098 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.3 t -102.61 137.14 31.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.893 0.378 . . . . 0.0 111.114 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 11.0 tt -137.11 135.0 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.962 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' A' ' 10' ' ' TYR . 13.5 tp -95.57 106.09 18.14 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.071 179.841 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -90.79 103.39 16.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.985 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.878 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.516 -0.349 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.1 m-85 -101.79 105.91 16.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.069 0.461 . . . . 0.0 110.186 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 19.0 mttt -125.21 151.91 45.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.332 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -103.85 142.62 17.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.184 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -136.33 131.94 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.863 0.363 . . . . 0.0 111.342 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.536 HD13 HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -105.36 -5.46 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.69 173.54 28.3 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 119.236 -1.459 . . . . 0.0 114.43 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.725 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.41 142.74 23.38 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.605 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -147.75 150.62 34.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.038 0.447 . . . . 0.0 111.405 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -60.54 -15.07 23.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.415 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.4 t -106.54 129.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 121.112 0.482 . . . . 0.0 111.785 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.2 ttpt -71.88 -39.17 69.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.512 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.72 -32.0 66.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.132 0.491 . . . . 0.0 109.827 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -77.51 -34.43 54.04 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.259 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -19.49 60.98 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.839 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.67 -38.34 21.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -38.03 88.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.803 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.5 tp -65.95 -50.06 65.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.217 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.54 -24.32 60.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.485 179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.85 -41.5 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.612 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.803 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -58.68 -47.38 84.68 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.513 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.51 -40.29 94.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.522 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.71 -37.31 65.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.304 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.32 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.36 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -62.5 -28.48 69.87 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.66 32.92 3.0 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.54 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.799 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -100.35 155.88 17.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -85.02 94.51 8.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.8 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.591 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.6 p -80.17 156.0 27.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.175 0.512 . . . . 0.0 111.017 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.66 137.71 7.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.913 -178.584 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 47.5 t -114.98 113.86 44.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.028 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.594 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.006 0.431 . . . . 0.0 110.499 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.45 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.9 m-85 . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.725 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.88 148.24 29.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.129 0.49 . . . . 0.0 111.815 -179.243 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.743 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.2 t -120.77 101.62 10.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.787 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.646 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.9 tt0 -107.5 142.19 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.864 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.13 123.07 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.518 0.675 . . . . 0.0 111.449 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.552 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.11 105.57 0.22 Allowed Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.865 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.571 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.1 124.87 40.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.647 0.261 . . . . 0.0 110.505 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.69 172.99 11.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.136 0.493 . . . . 0.0 111.499 -179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -83.04 -15.92 49.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.997 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 128.52 56.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.898 0.38 . . . . 0.0 111.028 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -56.32 -34.92 67.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.212 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.48 -30.88 32.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.443 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 33.7 m120 -70.8 -50.24 37.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.681 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.599 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.75 -40.2 87.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.926 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -60.47 -51.47 69.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -59.02 -35.98 74.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.63 -52.04 29.52 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.846 0.831 . . . . 0.0 110.131 179.518 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.69 -59.05 5.11 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.993 -177.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.6 -36.75 56.9 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.522 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.5 ttt180 -64.33 -38.72 92.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.766 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.94 -40.88 95.71 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.543 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.9 mttm -61.86 -46.88 87.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.678 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.52 -25.69 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.817 178.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.475 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.08 -22.54 52.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.4 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.1 23.93 5.34 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.581 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.41 148.46 52.66 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.6 t70 -92.33 74.32 5.3 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.579 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.33 142.9 29.85 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-O 121.234 0.54 . . . . 0.0 111.845 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.51 152.74 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.016 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.8 t -104.91 134.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.902 0.382 . . . . 0.0 110.848 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.5 tt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.286 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.516 -0.341 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.9 m-85 -101.7 105.74 16.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.127 0.489 . . . . 0.0 110.241 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -125.4 157.3 37.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.019 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -110.57 136.24 47.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.356 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.096 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.5 135.32 47.83 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 111.453 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.652 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.32 -6.16 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.47 177.0 29.21 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 119.176 -1.488 . . . . 0.0 114.595 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.646 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 144.05 24.12 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.635 ' HE1' HD22 ' A' ' 26' ' ' LEU . 5.0 m-85 -147.86 149.65 32.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.382 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -14.31 26.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.47 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 125.28 62.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.041 0.448 . . . . 0.0 111.985 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.2 tmtt? -67.11 -41.01 86.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.492 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.65 66.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.118 0.485 . . . . 0.0 109.906 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -77.93 -35.46 50.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.391 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.98 -19.08 61.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.802 179.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.53 -37.51 21.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.639 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -37.33 86.14 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.826 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.5 tp -66.82 -51.01 60.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.999 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.15 -24.62 59.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.599 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -72.53 -41.41 65.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.519 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.826 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.89 -47.71 84.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.588 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.87 -40.91 94.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.597 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -55.22 -37.14 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.382 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.91 -50.85 65.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.235 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.7 mmtt -62.45 -28.53 69.87 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.5 31.52 3.21 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.519 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.6 m-85 -100.49 157.26 16.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 0.0 110.794 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -86.81 93.98 9.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.758 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.621 ' HA ' HG22 ' A' ' 50' ' ' ILE . 99.2 p -80.29 157.78 26.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.138 0.494 . . . . 0.0 110.918 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.525 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.27 138.51 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.01 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.592 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.1 t -117.41 116.71 52.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.023 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.602 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.0 110.692 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 m-85 . . . . . 0 C--O 1.23 0.062 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.88 146.55 28.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.126 0.489 . . . . 0.0 111.722 -179.45 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.784 ' CB ' HD23 ' A' ' 26' ' ' LEU . 99.4 t -120.99 102.59 12.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.678 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.525 ' HB3' HG23 ' A' ' 38' ' ' ILE . 36.3 tt0 -111.38 143.76 41.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.274 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.38 123.82 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.525 0.679 . . . . 0.0 111.454 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.53 109.78 0.29 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.04 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -132.85 122.38 24.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.747 0.308 . . . . 0.0 110.259 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.66 175.44 9.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.071 0.462 . . . . 0.0 111.621 -179.248 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.65 -15.38 39.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.124 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.7 t -112.07 126.94 55.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -55.63 -36.28 66.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.178 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -53.04 -30.05 33.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.904 0.383 . . . . 0.0 110.99 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.474 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 5.1 m120 -72.84 -49.37 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.741 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.456 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.81 -40.96 94.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.003 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -60.38 -49.99 75.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.824 0.345 . . . . 0.0 110.83 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.7 m -58.01 -37.77 74.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.783 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.019 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.8 -50.42 50.42 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.782 0.801 . . . . 0.0 110.177 179.297 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.2 -60.81 2.82 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.306 -1.315 . . . . 0.0 111.098 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.7 54.28 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.691 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.46 -38.02 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.75 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.67 -41.71 92.15 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.714 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.3 mttm -62.04 -46.37 89.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.597 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.28 -25.73 63.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.737 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.485 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.23 -23.83 54.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.8 24.51 4.9 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.546 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.68 149.03 52.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.26 72.51 4.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.83 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 144.75 26.52 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.07 0.462 . . . . 0.0 111.69 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.0 pp -133.43 157.67 42.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.756 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 12' ' ' VAL . 84.0 t -109.84 134.68 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.976 0.417 . . . . 0.0 111.029 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 74' ' ' ILE . 1.7 pt . . . . . 0 C--O 1.237 0.41 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.364 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mp . . . . . 0 CA--C 1.517 -0.307 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.514 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.2 m-85 -101.92 106.61 17.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.077 0.465 . . . . 0.0 110.05 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.0 mttt -126.45 155.36 42.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.644 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.036 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.27 137.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.395 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -129.96 135.82 48.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.572 0.225 . . . . 0.0 110.996 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.22 -6.35 11.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -179.124 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.91 174.34 28.49 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 119.047 -1.549 . . . . 0.0 114.781 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.715 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.8 143.33 23.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -145.89 149.15 33.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 111.323 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.488 ' HG3' HG23 ' A' ' 19' ' ' VAL . 4.7 ptpp? -61.7 -13.56 23.93 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.345 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.488 HG23 ' HG3' ' A' ' 18' ' ' LYS . 21.3 t -107.43 126.44 63.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.061 0.458 . . . . 0.0 111.94 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 46' ' ' TYR . 5.5 tmtt? -65.87 -42.19 90.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.591 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.54 -33.13 65.8 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.166 0.508 . . . . 0.0 109.895 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -77.16 -36.21 55.37 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.44 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.84 62.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.666 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -35.73 26.88 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 t -64.87 -36.69 85.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.964 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.48 -50.98 48.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.383 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -56.89 -25.25 56.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.067 0.46 . . . . 0.0 110.592 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -41.37 60.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.761 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.964 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.04 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.845 0.355 . . . . 0.0 110.401 179.873 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.978 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.71 -40.35 87.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.308 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -55.37 -36.45 66.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.88 -51.74 54.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.354 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -62.83 -28.49 70.05 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.5 34.25 2.92 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.502 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.77 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.6 m-85 -100.84 156.12 17.55 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.126 0.488 . . . . 0.0 110.92 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.33 89.92 7.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.529 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.657 ' HA ' HG22 ' A' ' 50' ' ' ILE . 1.1 m -80.33 158.68 26.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 110.526 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.501 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -156.87 141.64 8.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.17 -178.372 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 58.8 t -117.81 116.5 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.005 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.597 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.813 0.339 . . . . 0.0 110.658 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 20' ' ' LYS . 25.0 m-85 . . . . . 0 N--CA 1.457 -0.08 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.06 147.92 27.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.175 0.512 . . . . 0.0 111.744 -179.307 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.783 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.5 t -123.08 103.41 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 38' ' ' ILE . 12.5 tt0 -108.97 143.18 38.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.123 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.978 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.9 pp -135.27 123.89 40.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.519 0.676 . . . . 0.0 111.574 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.409 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.73 104.98 0.25 Allowed Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.913 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.01 112.78 14.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.709 0.29 . . . . 0.0 110.339 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.9 171.13 14.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 0.0 111.467 -179.302 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -81.42 -16.44 52.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.007 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.34 131.47 56.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.869 0.366 . . . . 0.0 111.07 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.0 ttpt -58.14 -37.76 75.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.314 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -46.32 -32.54 3.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.094 0.473 . . . . 0.0 110.825 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.461 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 10.4 m120 -73.46 -48.83 30.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.28 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.79 -45.53 89.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.163 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.83 -51.1 71.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 71.5 m -59.19 -35.67 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.884 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.036 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.51 -51.92 31.33 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 121.815 0.817 . . . . 0.0 110.129 179.488 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -59.69 4.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.021 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.06 46.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.387 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt-85 -65.33 -39.9 93.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.88 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.18 -40.97 97.21 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.703 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 40.6 mttm -62.34 -46.85 86.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.664 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.53 -25.44 64.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.794 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.81 -22.49 53.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.368 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.19 23.92 5.61 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.73 149.0 52.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.255 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 31.2 t0 -92.25 74.23 5.37 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.821 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.67 140.51 30.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.088 0.471 . . . . 0.0 111.842 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pt -132.66 149.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.085 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 91.7 t -102.78 135.8 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 0.0 110.969 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 pt . . . . . 0 C--O 1.236 0.365 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.411 -179.93 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 CA--C 1.516 -0.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.1 m-85 -101.4 106.45 17.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.312 -0.403 . . . . 0.0 109.987 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttm -126.03 155.7 41.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.007 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.25 142.77 19.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.211 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.301 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 3.6 tt0 -135.15 132.83 38.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 111.166 -179.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.539 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.09 -5.39 10.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.83 174.1 28.09 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 119.209 -1.472 . . . . 0.0 114.562 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.76 143.85 23.9 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.364 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.572 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -147.37 151.45 36.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.374 . . . . 0.0 111.286 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -61.14 -15.57 34.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.385 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.4 t -105.8 128.4 60.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 121.032 0.444 . . . . 0.0 112.073 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.4 tmtt? -68.62 -42.59 77.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.481 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.44 -31.29 61.78 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.128 0.489 . . . . 0.0 109.95 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -77.94 -35.2 50.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.464 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.67 -21.19 61.84 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.12 -37.55 23.62 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.441 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -65.15 -36.11 83.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.23 0.538 . . . . 0.0 109.612 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.5 tp -69.07 -48.2 63.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.286 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.401 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.16 -25.93 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.064 0.459 . . . . 0.0 110.426 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.2 t -75.1 -40.63 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.36 -48.25 82.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.921 0.391 . . . . 0.0 110.709 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.92 -38.38 90.73 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.352 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.76 -36.41 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.323 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -50.99 64.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.513 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 9.6 mmpt? -62.2 -28.01 69.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.37 32.39 3.22 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.421 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -99.64 154.76 18.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.01 0.433 . . . . 0.0 110.751 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.39 92.58 7.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.751 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 98.0 p -79.95 156.06 27.41 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.036 0.446 . . . . 0.0 110.967 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.632 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.65 141.47 7.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.772 -178.401 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.597 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.4 t -120.02 119.13 59.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.295 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.593 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 110.394 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.7 m-85 . . . . . 0 C--O 1.228 -0.028 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.713 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.7 149.3 27.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 111.79 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.797 ' HB ' HD23 ' A' ' 26' ' ' LEU . 61.8 t -123.0 104.36 14.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.683 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.632 ' HB3' HG23 ' A' ' 38' ' ' ILE . 4.8 tt0 -109.39 142.75 39.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.117 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.04 123.66 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-O 121.551 0.691 . . . . 0.0 111.592 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.91 103.91 0.26 Allowed Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.991 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.441 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -125.31 122.69 37.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.85 172.02 13.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.485 . . . . 0.0 111.567 -179.042 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.41 -16.97 47.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.005 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.12 130.8 56.57 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.827 0.346 . . . . 0.0 111.095 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.6 ttpt -57.95 -38.03 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.359 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -46.46 -31.31 2.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.967 0.413 . . . . 0.0 110.775 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.637 ' O ' HG22 ' A' ' 61' ' ' THR . 6.4 m120 -74.07 -48.69 28.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.379 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.13 -44.63 94.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.155 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -59.07 -52.01 67.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.125 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.9 t -59.49 -34.15 72.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.925 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.007 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -51.88 28.58 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.701 0.763 . . . . 0.0 109.932 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.738 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.11 8.57 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.878 -177.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.43 -35.96 61.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt180 -64.91 -39.48 93.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.682 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.91 -40.75 95.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.584 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 26.3 mttm -61.98 -47.34 85.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.706 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.78 -25.92 64.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.83 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.501 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.98 -21.9 54.0 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.388 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.92 23.91 5.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.484 -179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.573 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.01 148.89 52.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 28.1 t70 -92.37 74.58 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.926 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.13 142.0 29.81 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.104 0.478 . . . . 0.0 111.868 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.3 pt -133.77 151.47 33.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.881 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.521 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.7 t -104.68 134.6 45.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.978 0.418 . . . . 0.0 111.05 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.409 ' C ' HD13 ' A' ' 76' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.019 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.0 mt . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.511 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.3 m-85 -102.0 105.64 16.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.011 0.434 . . . . 0.0 110.109 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -124.99 156.36 38.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.437 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -110.5 138.14 39.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.318 179.865 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 14.0 tt0 -132.22 136.48 47.03 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.888 0.375 . . . . 0.0 111.167 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.66 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.02 -5.39 10.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -179.085 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.38 173.45 28.95 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 118.942 -1.599 . . . . 0.0 114.93 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.785 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.4 142.7 23.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.958 -0.621 . . . . 0.0 109.472 178.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.579 ' CE1' HD22 ' A' ' 26' ' ' LEU . 2.5 m-85 -146.16 149.23 33.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.878 0.37 . . . . 0.0 111.254 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -60.81 -15.31 28.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.419 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.83 130.27 60.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.637 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -69.43 -40.15 77.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.633 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -35.54 66.11 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.286 0.565 . . . . 0.0 109.619 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -73.99 -34.2 64.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.209 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.45 -19.74 61.51 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.761 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -35.49 25.58 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.474 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 t -67.68 -38.92 84.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 0.0 109.724 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.728 HD23 ' HB ' ' A' ' 48' ' ' VAL . 20.4 tp -65.84 -53.29 41.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.379 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.35 -24.52 63.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -70.85 -42.39 70.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.537 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.724 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.89 -46.25 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.518 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.997 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.668 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.43 -37.18 67.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.149 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.94 -49.99 67.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.268 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.83 -29.04 70.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.423 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.14 32.92 2.89 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.539 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.758 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.9 m-85 -101.47 158.36 16.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.053 0.454 . . . . 0.0 110.544 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -87.27 94.86 9.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.634 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.607 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 35.0 p -80.07 157.38 26.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.845 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.59 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.91 137.43 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.752 -178.472 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.7 t -114.22 112.83 41.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.199 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.599 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.165 0 CA-C-O 121.013 0.435 . . . . 0.0 110.921 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.1 m-85 . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.38 148.84 28.57 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.156 0.503 . . . . 0.0 111.993 -179.558 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.728 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.9 t -121.89 99.01 6.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.307 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.59 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.2 tt0 -106.42 143.04 35.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.075 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.997 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.75 123.35 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 111.513 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.76 110.12 0.3 Allowed Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 114.763 -1.108 . . . . 0.0 113.053 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -134.66 112.91 11.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.744 0.307 . . . . 0.0 110.52 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.5 174.53 10.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.039 0.447 . . . . 0.0 111.57 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -84.73 -16.24 42.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.19 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.68 128.3 56.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.9 0.381 . . . . 0.0 111.044 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.511 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.0 -36.86 65.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.228 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -53.01 -30.23 34.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.439 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -72.18 -49.21 37.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.803 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.99 -41.2 97.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.002 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.61 -50.99 71.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.971 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.2 m -57.12 -37.64 72.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.811 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -50.1 53.82 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.737 0.78 . . . . 0.0 110.279 179.42 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.733 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.93 -60.64 3.06 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.166 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.74 59.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -63.88 -40.11 95.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.068 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.43 -40.5 95.87 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.69 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 33.3 mttm -62.03 -46.77 87.74 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -69.32 -26.37 64.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.826 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.61 -22.44 54.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.411 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.73 24.19 5.35 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.568 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.74 148.91 52.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 36.4 t70 -92.63 72.71 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.6 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.16 141.87 29.88 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.149 0.499 . . . . 0.0 111.745 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 7.6 pt -133.11 154.75 40.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.925 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.639 HG22 HG13 ' A' ' 12' ' ' VAL . 92.1 t -108.48 135.82 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.953 0.406 . . . . 0.0 110.881 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 pt . . . . . 0 C--O 1.237 0.425 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.562 -179.725 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.605 HD13 ' HZ1' ' A' ' 11' ' ' LYS . 1.4 mt . . . . . 0 CA--C 1.516 -0.341 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.9 m-85 -101.96 105.84 16.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.044 0.449 . . . . 0.0 110.214 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.605 ' HZ1' HD13 ' A' ' 9' ' ' LEU . 2.5 mttm -125.83 153.01 44.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.448 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.027 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.7 136.37 41.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.372 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.358 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.19 135.38 48.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.598 0.237 . . . . 0.0 111.021 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.573 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -6.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.789 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.41 172.09 29.4 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 118.834 -1.65 . . . . 0.0 114.885 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.55 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.92 138.1 19.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.849 -0.675 . . . . 0.0 109.486 178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -148.72 150.76 33.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 111.079 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -61.21 -12.65 13.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.068 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -109.13 129.9 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 111.907 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.7 -38.35 67.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.592 179.811 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.8 -34.86 63.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.328 0.585 . . . . 0.0 109.634 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -75.4 -31.87 60.56 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.178 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.36 -18.86 60.62 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.93 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -84.71 -38.18 20.04 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.634 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -68.43 -35.73 78.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 109.588 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.829 HD12 ' ND2' ' A' ' 29' ' ' ASN . 56.7 tp -68.14 -51.99 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.119 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.97 -24.43 62.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.408 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.7 m -71.32 -41.27 70.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.5 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.829 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.64 -46.93 87.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.446 179.568 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.949 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.67 -41.45 90.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.556 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -55.63 -36.83 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.233 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.38 -51.19 63.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.393 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.6 mmpt? -62.73 -28.54 70.03 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.91 32.8 2.98 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.513 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.783 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -101.16 157.62 16.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 110.809 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.41 92.23 8.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.656 ' HA ' HG22 ' A' ' 50' ' ' ILE . 77.3 p -80.35 156.66 26.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.142 0.496 . . . . 0.0 111.033 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.89 141.86 5.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.527 -178.84 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.559 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.0 t -114.65 111.68 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.175 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.605 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 120.918 0.39 . . . . 0.0 110.511 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.6 m-85 . . . . . 0 C--O 1.228 -0.057 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -122.23 158.89 28.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.652 HG21 ' HB3' ' A' ' 26' ' ' LEU . 93.0 t -122.99 114.08 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.296 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.572 ' HB3' HG23 ' A' ' 38' ' ' ILE . 23.2 tt0 -112.45 137.52 50.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.797 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.949 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.54 123.97 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.625 0.726 . . . . 0.0 111.488 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.55 102.35 0.21 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.085 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.11 120.99 31.6 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -141.04 174.32 10.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.153 0.501 . . . . 0.0 111.589 -179.065 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.1 m -84.72 -15.76 44.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.001 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -112.42 128.08 56.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.79 0.329 . . . . 0.0 111.098 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -56.6 -35.18 67.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.27 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -51.86 -31.5 28.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.85 0.357 . . . . 0.0 110.98 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 9.9 m120 -71.98 -49.74 34.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.577 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.95 -42.24 93.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.17 -50.93 71.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.819 0.342 . . . . 0.0 110.793 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.8 m -58.54 -37.12 75.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.824 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.027 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.52 -51.27 44.86 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.752 0.787 . . . . 0.0 110.154 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.39 -59.97 3.97 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.091 -177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.31 -36.62 43.51 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -65.69 -39.53 91.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.836 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.0 -41.88 94.97 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.562 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.0 mmmm -61.79 -46.8 87.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.795 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -69.85 -25.55 63.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.747 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.469 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.38 -22.43 54.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.381 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.94 23.39 5.59 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.446 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.39 147.6 52.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 33.8 t70 -91.02 73.36 6.41 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.675 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.6 140.55 30.5 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.105 0.478 . . . . 0.0 111.871 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 pt -132.53 151.15 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.833 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.504 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.4 t -103.95 135.72 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.858 0.361 . . . . 0.0 110.982 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.0 pt . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.249 -179.802 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.515 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.5 m-85 -101.94 105.72 16.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.035 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.49 152.98 44.24 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.35 137.72 35.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.131 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -132.96 134.47 44.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.698 0.285 . . . . 0.0 111.253 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.581 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.86 -4.79 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.96 174.7 29.01 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 119.135 -1.507 . . . . 0.0 114.766 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.76 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.19 141.78 22.63 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.621 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -147.87 149.8 32.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.025 0.441 . . . . 0.0 111.351 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -61.58 -13.74 24.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -106.58 126.18 62.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.794 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.12 -40.57 82.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.469 179.58 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.49 -32.27 64.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.263 0.554 . . . . 0.0 109.9 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -77.54 -34.01 54.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.395 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.506 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.92 -19.54 60.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.849 179.192 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.43 -37.49 21.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.562 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -38.63 88.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.297 0.57 . . . . 0.0 109.63 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 40.5 tp -66.09 -51.48 57.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.188 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.524 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.19 -23.93 57.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.543 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.1 m -73.0 -41.32 64.42 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.677 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.27 -47.16 86.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.604 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.68 -40.61 95.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.578 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -55.14 -37.24 66.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.283 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.76 -49.93 69.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.27 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -62.39 -28.49 69.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.93 31.43 3.36 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.555 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.781 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.1 156.07 17.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.92 0.39 . . . . 0.0 110.799 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.88 93.13 8.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.696 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.0 p -80.28 157.22 26.49 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 121.128 0.489 . . . . 0.0 110.926 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.95 139.66 6.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.705 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.5 t -116.41 115.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.219 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.597 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.812 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 29.6 m-85 . . . . . 0 N--CA 1.462 0.137 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.76 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.55 148.65 28.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.179 0.514 . . . . 0.0 111.84 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.789 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.8 t -120.54 100.41 9.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.393 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.556 ' HB3' HG23 ' A' ' 38' ' ' ILE . 31.5 tt0 -108.97 142.39 39.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.319 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -136.31 122.98 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.538 0.685 . . . . 0.0 111.657 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.16 107.67 0.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.912 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.12 118.59 21.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.651 0.262 . . . . 0.0 110.428 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -138.31 172.79 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 111.48 -179.301 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -84.15 -15.49 46.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.092 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.29 128.81 56.38 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.0 tmtm? -55.65 -35.58 66.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.275 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -53.17 -29.96 34.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.455 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 26.4 m120 -71.56 -49.85 36.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.721 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.515 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.99 -40.87 95.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.061 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.2 -50.96 71.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.741 0.305 . . . . 0.0 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 13.6 m -58.59 -37.46 75.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.58 -51.03 47.03 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.732 0.777 . . . . 0.0 110.085 179.449 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.36 -59.99 3.95 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.093 -177.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.84 -36.05 46.77 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.43 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.98 -38.74 89.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.871 178.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.14 96.28 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.662 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -62.27 -46.25 89.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.722 178.776 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -25.54 63.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.694 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.481 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.45 -23.64 53.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.35 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.9 23.38 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.552 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.549 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.67 148.26 52.44 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 45.6 t0 -91.79 74.03 5.75 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.644 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.07 142.29 30.52 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.066 0.46 . . . . 0.0 111.956 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.4 pt -133.12 151.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.8 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.515 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.5 t -105.42 135.41 43.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.393 . . . . 0.0 111.125 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 30.1 pt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.221 -179.842 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 9' ' ' LEU . 3.4 mm? . . . . . 0 CA--C 1.515 -0.397 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -100.93 106.77 18.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.195 0.522 . . . . 0.0 110.17 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.406 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 6.7 mttm -125.85 152.97 44.79 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.403 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.032 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.18 140.57 22.81 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.209 179.89 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.421 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 42.2 tt0 -132.92 131.81 41.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.717 0.294 . . . . 0.0 111.281 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.569 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.02 -5.57 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -179.284 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.19 172.28 28.31 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 119.104 -1.522 . . . . 0.0 114.634 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.763 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 141.07 22.09 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 114.884 -0.658 . . . . 0.0 109.254 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.581 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.3 m-85 -146.63 150.28 35.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.913 0.387 . . . . 0.0 111.357 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -13.81 22.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.424 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.45 128.5 60.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.046 0.451 . . . . 0.0 111.989 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 7.2 tmtt? -69.34 -41.13 77.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.487 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.74 -31.06 64.18 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.171 0.51 . . . . 0.0 109.924 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -78.07 -35.1 49.9 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.335 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.56 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.32 -22.99 61.85 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.772 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -38.66 26.85 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.531 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -63.67 -37.73 88.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.228 0.537 . . . . 0.0 109.653 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.2 tp -67.31 -46.03 74.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.198 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -59.39 -26.59 65.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.462 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -41.05 60.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.21 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.1 -48.07 82.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.695 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -63.2 -38.2 90.22 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.348 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -54.85 -36.65 65.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.462 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.01 -51.55 56.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.557 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 7.5 mmtm -62.64 -28.13 69.7 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.78 34.47 2.81 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.461 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.61 155.41 17.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.975 0.416 . . . . 0.0 110.85 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -83.46 94.34 7.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.824 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.574 ' HA ' HG22 ' A' ' 50' ' ' ILE . 80.1 p -79.96 155.2 27.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.971 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.653 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.9 139.95 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.699 -178.503 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.63 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -118.59 116.25 50.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.391 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.593 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 110.724 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.7 m-85 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.763 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.14 150.59 27.02 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 111.541 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.824 ' HB ' HD23 ' A' ' 26' ' ' LEU . 98.3 t -124.36 102.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.633 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.6 tt0 -106.84 142.86 35.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.047 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.62 123.16 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.472 0.654 . . . . 0.0 111.488 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.522 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.22 105.52 0.23 Allowed Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.894 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.57 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.88 122.38 32.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.659 0.266 . . . . 0.0 110.397 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -140.74 171.62 13.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.203 0.525 . . . . 0.0 111.454 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -17.25 51.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.866 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.0 t -113.78 130.27 56.47 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.865 0.365 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 13.3 ttpt -57.13 -37.47 72.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.398 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.11 -31.16 3.25 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.966 0.412 . . . . 0.0 110.698 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CD1' ' A' ' 53' ' ' PHE . 19.8 m120 -73.28 -49.99 24.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.235 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.556 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.73 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.12 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.24 -51.15 71.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.844 0.355 . . . . 0.0 111.009 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 28.3 m -58.84 -35.21 72.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.918 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.032 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.33 -51.95 26.33 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.747 0.785 . . . . 0.0 110.187 179.435 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.744 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.99 -57.9 9.29 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.231 -1.35 . . . . 0.0 111.013 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.36 -37.39 62.35 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.429 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.4 ttt-85 -64.47 -38.23 90.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.639 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.27 -41.15 94.49 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.624 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.8 mttm -62.17 -46.94 86.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.691 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.29 -25.44 64.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.686 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.468 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.16 -22.54 52.37 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.36 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 23.59 5.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.584 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.563 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.36 148.93 52.72 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.447 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.5 74.74 5.16 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.807 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.47 141.83 29.65 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.062 0.458 . . . . 0.0 111.95 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.587 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -133.27 152.11 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.02 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.556 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.9 t -104.78 136.35 38.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.798 0.333 . . . . 0.0 111.085 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.587 HG23 HD12 ' A' ' 74' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.354 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.515 -0.377 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.513 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.6 m-85 -101.43 106.62 17.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.037 0.446 . . . . 0.0 109.997 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.49 155.45 38.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.429 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.001 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.78 142.92 18.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.284 179.876 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -133.91 132.74 40.62 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.581 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.07 -5.97 9.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.76 173.79 29.8 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 118.877 -1.63 . . . . 0.0 114.893 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' HG3' ' A' ' 47' ' ' LYS . . . -151.01 135.91 17.36 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.962 -0.619 . . . . 0.0 109.71 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.633 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.0 m-85 -145.01 149.37 35.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.8 0.334 . . . . 0.0 111.08 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -60.78 -14.13 19.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.937 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -106.76 127.99 61.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.062 0.458 . . . . 0.0 112.107 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -69.64 -42.27 74.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.579 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.11 -32.52 47.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.177 0.513 . . . . 0.0 109.815 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -76.94 -32.58 57.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.282 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.501 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.09 -20.63 60.2 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.891 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -39.13 20.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 110.747 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 t -66.61 -37.13 84.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 0.0 109.659 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.8 tp -66.47 -52.1 49.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.182 179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.654 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.03 -24.45 58.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.441 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.1 t -71.83 -41.74 67.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.556 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.88 -47.55 84.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.571 179.599 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.09 -41.41 92.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.648 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.15 -37.02 66.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.234 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.8 -51.12 64.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.341 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.43 -28.43 69.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.73 31.69 3.11 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.687 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.79 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -101.01 158.0 16.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 94.9 9.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.751 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.654 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 47.5 p -80.29 156.83 26.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.227 0.537 . . . . 0.0 110.982 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.63 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -155.97 137.13 5.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.659 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.501 HG13 ' HB1' ' A' ' 23' ' ' ALA . 39.3 t -113.98 112.67 41.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.607 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 CA-C-O 120.934 0.397 . . . . 0.0 110.614 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.45 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.8 m-85 . . . . . 0 C--O 1.225 -0.2 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.547 ' HG3' ' HB1' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.55 156.53 31.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.12 0.486 . . . . 0.0 111.613 -179.342 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.689 ' HB ' HD23 ' A' ' 26' ' ' LEU . 87.9 t -125.43 113.96 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.48 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.63 ' HB3' HG23 ' A' ' 38' ' ' ILE . 3.3 tt0 -111.93 141.32 45.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.1 123.44 39.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.515 0.674 . . . . 0.0 111.575 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.29 107.59 0.28 Allowed Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.823 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.495 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -129.37 118.37 22.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.688 0.28 . . . . 0.0 110.553 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.03 174.21 10.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.011 0.434 . . . . 0.0 111.551 -179.402 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.4 p -83.57 -17.04 43.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.093 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -112.55 128.34 56.33 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.85 0.357 . . . . 0.0 111.174 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.513 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.53 -34.74 64.96 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.082 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -52.23 -32.0 34.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.045 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.9 m120 -70.89 -49.6 44.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.617 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.46 -40.54 82.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.012 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -61.66 -49.98 74.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.761 0.315 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 1.1 m -59.48 -34.76 72.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.837 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.001 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.01 -51.52 24.95 Favored 'General case' 0 CA--C 1.503 -0.843 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.726 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.25 8.03 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.922 -177.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.67 -37.26 63.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.662 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 61' ' ' THR . 5.5 ttt180 -64.19 -38.73 92.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.777 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.79 -41.05 96.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.67 -46.38 89.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.76 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -69.79 -26.09 64.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.803 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.76 -22.85 53.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.404 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.25 23.59 5.42 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.466 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.566 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.72 148.8 52.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.4 t70 -92.34 73.53 5.29 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.675 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.43 142.79 28.99 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.116 0.484 . . . . 0.0 111.985 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.9 pt -134.69 162.01 39.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.617 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.0 t -112.29 137.03 46.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.323 -179.897 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -100.83 106.63 18.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.074 0.464 . . . . 0.0 110.069 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -126.31 156.77 39.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.52 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.045 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.92 138.99 31.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.316 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.145 179.761 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -131.22 133.75 45.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.717 0.294 . . . . 0.0 111.158 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.518 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.55 -5.64 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.41 175.21 29.08 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.055 -1.545 . . . . 0.0 114.558 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.623 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.62 142.54 23.0 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.995 -0.603 . . . . 0.0 109.426 178.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.611 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.8 m-85 -147.53 150.13 33.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.878 0.37 . . . . 0.0 111.346 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.3 pttt -61.72 -13.63 24.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.489 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.27 127.04 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.176 0.512 . . . . 0.0 111.959 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.09 -42.12 80.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.574 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.23 -31.69 63.77 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.148 0.499 . . . . 0.0 110.02 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -78.22 -34.94 49.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.5 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -19.21 61.04 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.881 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.95 -37.66 20.24 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.496 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -37.73 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 59.6 tp -66.26 -51.63 55.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.127 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -57.67 -23.87 53.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.534 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -41.15 64.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.63 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.08 -46.98 86.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.965 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.1 -40.41 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -55.28 -37.11 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.275 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.17 -50.81 66.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.376 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.3 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.07 32.3 3.08 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.537 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.78 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.1 m-85 -100.55 155.8 17.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.949 0.404 . . . . 0.0 110.858 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.44 92.41 8.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.697 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.632 ' HA ' HG22 ' A' ' 50' ' ' ILE . 96.4 p -80.12 157.4 26.65 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.175 0.512 . . . . 0.0 110.894 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.85 142.35 6.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.739 -178.431 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.621 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -121.8 122.41 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.272 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.424 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.457 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.8 m-85 . . . . . 0 C--O 1.231 0.08 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.76 147.03 27.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.917 0.389 . . . . 0.0 111.831 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.755 ' CB ' HD23 ' A' ' 26' ' ' LEU . 98.7 t -120.96 105.2 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.737 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 15.3 tt0 -111.86 142.04 44.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.416 -179.389 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.965 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.38 123.78 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-O 121.588 0.708 . . . . 0.0 111.561 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.402 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 81.08 106.32 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.872 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.11 117.45 20.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.666 0.269 . . . . 0.0 110.492 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -137.09 170.11 16.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.138 0.494 . . . . 0.0 111.422 -179.334 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -17.08 53.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.47 131.71 56.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.95 0.405 . . . . 0.0 110.947 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.498 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 5.0 ttpt -57.63 -37.96 74.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.376 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -46.04 -32.98 3.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.049 0.452 . . . . 0.0 110.854 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 13.2 m120 -71.91 -49.2 39.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.411 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.655 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.06 -44.57 87.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.084 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.29 -52.31 66.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.76 0.314 . . . . 0.0 111.209 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.47 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.04 -34.58 72.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.103 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.045 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.3 -51.9 26.86 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.718 0.77 . . . . 0.0 110.135 179.429 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.5 -59.13 5.11 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.029 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.72 -37.21 50.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.276 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.0 -38.25 90.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.784 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.34 -41.91 93.44 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.762 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.9 mttm -62.09 -46.83 87.35 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.638 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.58 -25.29 63.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.811 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.2 -23.3 51.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.336 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.64 23.36 5.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.412 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.18 149.18 52.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.2 t70 -92.98 74.59 4.78 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.662 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.5 143.41 28.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.135 0.493 . . . . 0.0 111.778 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.5 pt -134.69 151.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.837 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.655 HG22 ' HB1' ' A' ' 59' ' ' ALA . 88.1 t -103.61 135.78 39.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.26 -179.946 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 CA--C 1.516 -0.339 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.516 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.6 m-85 -101.86 106.79 17.81 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.142 0.496 . . . . 0.0 109.874 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 34.9 mttm -125.05 154.41 41.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.649 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -108.33 137.02 42.06 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.205 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -129.6 135.46 48.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.651 0.263 . . . . 0.0 111.008 -179.391 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.552 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.23 -5.03 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.64 173.52 28.22 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 118.964 -1.589 . . . . 0.0 114.559 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.612 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.87 143.49 23.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.861 -0.669 . . . . 0.0 109.29 178.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.9 m-85 -150.03 148.29 28.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.89 0.376 . . . . 0.0 111.393 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -60.8 -13.88 18.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.609 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.08 124.46 61.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.158 0.504 . . . . 0.0 112.116 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -64.93 -44.69 88.68 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.602 179.634 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.65 -31.77 48.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.15 0.5 . . . . 0.0 109.856 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.92 -35.77 50.17 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.593 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.05 -21.51 61.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -37.72 24.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -64.46 -37.18 86.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 109.626 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.977 HD12 ' OD1' ' A' ' 29' ' ' ASN . 26.8 tp -67.41 -50.8 57.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.331 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.579 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.37 -26.39 52.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.083 0.468 . . . . 0.0 110.652 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.34 -41.04 61.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.084 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.977 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.45 -48.92 79.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.962 0.41 . . . . 0.0 110.772 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.948 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.14 -39.32 89.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -54.36 -37.15 64.61 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.16 -50.54 64.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.429 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpp? -62.41 -28.37 69.74 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 33.83 2.82 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.501 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.2 m-85 -102.05 159.89 14.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.989 0.423 . . . . 0.0 110.626 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -87.56 94.06 9.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.602 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.42 157.91 26.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.007 0.432 . . . . 0.0 110.789 -178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.481 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.42 140.12 6.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.007 -178.463 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.59 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 30.1 t -118.99 118.79 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.002 0.429 . . . . 0.0 110.572 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.2 m-85 . . . . . 0 N--CA 1.46 0.057 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.612 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -102.72 146.5 28.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.229 0.537 . . . . 0.0 111.872 -178.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.4 t -121.79 103.4 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.621 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.1 tt0 -110.62 143.64 40.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.634 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.948 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.18 123.1 32.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.58 0.705 . . . . 0.0 111.618 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.66 111.78 0.3 Allowed Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.145 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.415 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.99 112.72 11.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.248 . . . . 0.0 110.371 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -129.65 173.77 10.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 0.0 111.522 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 m -83.81 -17.66 40.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.967 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.8 131.94 56.04 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.873 0.368 . . . . 0.0 111.078 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpp -58.06 -39.62 78.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.271 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -46.07 -32.52 2.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.96 0.409 . . . . 0.0 110.761 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 71.0 m-80 -70.98 -49.64 43.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.367 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.711 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.49 -41.02 75.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.04 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -61.45 -49.26 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.87 0.367 . . . . 0.0 110.902 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -60.92 -34.93 75.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.855 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.054 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.88 -53.05 16.55 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.877 0.846 . . . . 0.0 110.047 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.71 -58.83 5.99 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.141 -1.391 . . . . 0.0 110.853 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.86 -37.77 53.43 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.413 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.8 ttt180 -64.86 -39.41 93.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.752 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.03 -41.76 94.96 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.603 179.123 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 29.9 mttt -62.05 -47.14 86.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.695 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -69.14 -25.59 64.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.723 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.68 -22.22 54.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.271 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.85 23.74 5.78 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -129.99 148.58 51.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.392 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.7 t0 -92.06 73.85 5.53 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.926 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.01 140.57 30.93 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.05 0.452 . . . . 0.0 111.913 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 20.7 pt -133.34 152.11 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.922 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.711 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.6 t -103.17 138.18 28.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.898 0.38 . . . . 0.0 111.156 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 pt . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.351 -179.894 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 CA--C 1.515 -0.369 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.5 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -101.28 106.38 17.57 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.064 0.459 . . . . 0.0 109.971 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.12 154.3 41.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.458 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.059 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.58 140.5 24.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.19 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -133.37 135.29 44.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 111.243 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.561 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -108.06 -5.43 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.229 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.33 174.23 28.8 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 118.968 -1.587 . . . . 0.0 114.646 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.765 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.21 141.42 22.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.939 -0.631 . . . . 0.0 109.389 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.638 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.8 m-85 -147.27 149.54 33.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.973 0.416 . . . . 0.0 111.377 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -12.83 16.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.09 125.93 63.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.078 0.466 . . . . 0.0 112.072 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 10.4 tmtt? -67.02 -42.02 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.414 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.63 -31.32 62.19 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.178 0.514 . . . . 0.0 109.909 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -78.36 -33.96 48.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.473 178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.07 -20.1 60.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.197 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -37.54 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -38.41 87.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.326 0.584 . . . . 0.0 109.512 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.815 HD12 ' ND2' ' A' ' 29' ' ' ASN . 41.8 tp -66.26 -51.49 57.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.21 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -57.93 -24.0 55.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.579 178.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t -72.92 -41.41 64.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.572 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.815 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.23 -47.03 86.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.568 179.834 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.97 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.58 -40.66 95.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.507 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -55.11 -37.26 66.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.312 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.28 67.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.171 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.36 -28.49 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.656 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.04 31.5 3.31 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.416 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.18 156.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.984 0.421 . . . . 0.0 110.777 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -85.68 93.33 8.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.728 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 81.7 p -80.43 157.6 26.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.23 0.538 . . . . 0.0 110.873 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.34 140.1 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.754 -178.543 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.15 116.31 51.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.272 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.592 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.179 0 CA-C-O 120.844 0.354 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.9 m-85 . . . . . 0 CA--C 1.527 0.083 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.765 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.79 148.78 28.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.056 0.455 . . . . 0.0 111.733 -179.567 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.796 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.5 t -121.31 100.9 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.653 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -107.51 142.1 37.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.162 -179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.97 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.0 123.59 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-O 121.653 0.74 . . . . 0.0 111.658 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.407 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.92 105.58 0.26 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.701 -1.136 . . . . 0.0 113.002 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.61 112.68 14.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.754 0.311 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.28 171.69 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.066 0.46 . . . . 0.0 111.62 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -17.45 50.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.8 t -114.44 132.67 56.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.018 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.5 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.8 ttpp -58.24 -37.68 75.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.336 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -46.47 -32.13 3.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.109 0.48 . . . . 0.0 110.825 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.447 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 30.5 m120 -72.57 -49.58 31.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.35 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.688 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.46 -44.74 85.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.157 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -59.71 -50.35 74.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.826 0.346 . . . . 0.0 110.987 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.44 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.0 m -60.17 -35.23 74.88 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.806 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.059 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -52.01 27.54 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-O 121.811 0.815 . . . . 0.0 109.989 179.493 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -58.72 6.38 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.179 -1.373 . . . . 0.0 111.066 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.27 -36.42 52.7 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.385 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt180 -65.82 -39.17 90.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.702 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.99 -41.16 97.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.574 178.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 36.8 mttm -61.88 -46.07 91.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.751 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -70.16 -25.48 63.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.806 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.482 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.07 -23.11 52.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.239 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.15 24.0 5.29 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.407 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.31 147.82 52.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 13.0 t70 -92.31 74.44 5.32 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.689 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.89 142.71 29.51 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.105 0.479 . . . . 0.0 111.908 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -133.94 153.04 35.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.855 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.688 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.0 t -102.83 136.06 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.955 0.407 . . . . 0.0 111.123 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt . . . . . 0 C--O 1.234 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.106 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.515 -0.396 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.8 m-85 -101.33 106.66 17.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 110.097 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -124.84 154.06 41.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.462 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.047 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.57 139.73 27.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.33 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -131.79 133.09 44.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.733 0.301 . . . . 0.0 111.058 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.58 -5.46 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -179.048 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.57 175.45 28.51 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 119.123 -1.513 . . . . 0.0 114.553 178.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.741 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.81 145.36 24.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.946 -0.627 . . . . 0.0 109.342 178.401 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.577 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.4 m-85 -149.11 153.1 37.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.123 0.487 . . . . 0.0 111.531 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -61.42 -16.78 50.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.255 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -106.93 129.25 60.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 112.182 -179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.6 OUTLIER -70.57 -39.89 73.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.316 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.03 -32.84 66.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 0.0 109.9 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -76.58 -34.66 58.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.254 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.65 -18.47 61.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.826 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -37.7 21.01 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.513 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.6 t -66.02 -38.04 87.43 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 57.3 tp -65.6 -51.34 60.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.058 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.635 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.04 -23.91 56.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.493 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.0 t -72.8 -41.25 65.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.545 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.55 -47.97 83.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.541 179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.55 -41.22 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.605 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.91 -37.43 66.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.36 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.06 69.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.359 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 12.6 mmtt -62.29 -28.28 69.61 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.72 31.33 3.21 Favored Glycine 0 N--CA 1.442 -0.918 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.608 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.764 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -101.6 158.81 15.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.915 0.388 . . . . 0.0 110.853 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.92 93.94 9.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.816 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.635 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 57.6 p -80.4 157.94 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.997 0.427 . . . . 0.0 110.813 -178.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.531 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -158.48 140.7 5.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.92 -178.569 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.37 117.46 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.07 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.333 -0.137 0 CA-C-O 120.996 0.427 . . . . 0.0 110.647 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 30.5 m-85 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.741 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.04 147.66 29.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.172 0.51 . . . . 0.0 111.955 -179.159 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.737 ' HB ' HD23 ' A' ' 26' ' ' LEU . 94.9 t -120.29 104.19 15.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.531 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.3 tt0 -109.6 141.26 42.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.359 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.3 123.7 39.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.602 0.715 . . . . 0.0 111.597 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.48 108.97 0.29 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.925 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.71 112.87 13.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.728 0.299 . . . . 0.0 110.377 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.16 170.38 14.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 111.432 -179.285 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 t -79.64 -18.27 51.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.027 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -115.33 137.87 51.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.92 0.39 . . . . 0.0 111.109 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -61.49 -38.9 88.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.634 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -45.83 -31.77 2.25 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.962 0.411 . . . . 0.0 111.016 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 27.0 m120 -73.14 -49.06 30.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.694 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.12 -43.3 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.991 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -60.91 -49.35 77.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.811 0.338 . . . . 0.0 110.938 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.1 m -61.17 -33.86 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.047 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.52 -52.49 18.02 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 121.739 0.78 . . . . 0.0 109.934 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.763 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.98 -57.86 9.96 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.787 -178.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.17 -37.72 55.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.41 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.1 ttt85 -65.21 -37.94 88.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.821 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.52 -42.83 91.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.611 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.3 mmmm -61.34 -46.56 89.74 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.854 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -70.24 -25.41 63.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.738 178.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.442 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.77 -22.96 53.0 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.56 23.43 5.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.483 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.584 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.87 148.12 52.6 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 32.4 t70 -91.89 75.04 5.65 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.565 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.63 141.69 29.61 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.846 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.584 HD12 HG23 ' A' ' 76' ' ' ILE . 1.2 pp -133.27 153.04 36.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.911 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.694 HG22 ' HB1' ' A' ' 59' ' ' ALA . 76.9 t -104.86 137.18 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.031 0.443 . . . . 0.0 111.14 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.584 HG23 HD12 ' A' ' 74' ' ' ILE . 6.7 pt . . . . . 0 C--O 1.236 0.367 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.208 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.516 -0.351 0 CA-C-O 120.742 0.306 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.8 m-85 -102.32 106.48 17.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.114 0.483 . . . . 0.0 109.968 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 42.6 mttt -124.51 154.78 40.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.467 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.68 145.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.309 179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tm0? -137.78 134.01 34.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -178.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.564 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.2 -5.41 10.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.77 169.47 27.31 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 119.256 -1.45 . . . . 0.0 114.623 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.74 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.93 140.75 21.85 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.508 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.7 m-85 -151.38 150.08 30.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -13.81 17.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.478 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.05 128.9 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-O 120.897 0.38 . . . . 0.0 111.794 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -71.8 -40.97 68.83 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.682 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.92 -29.51 20.46 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.232 0.539 . . . . 0.0 109.725 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -81.82 -31.88 31.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.726 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.76 -23.08 58.48 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.03 179.341 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -83.02 -40.36 20.04 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.624 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -37.29 86.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.211 0.529 . . . . 0.0 109.775 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.919 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.2 tp -68.21 -47.53 67.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.279 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.58 -25.85 63.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.046 0.45 . . . . 0.0 110.503 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -74.75 -41.08 60.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.045 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.919 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.05 -48.71 80.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.813 0.34 . . . . 0.0 110.627 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.88 -38.18 89.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.382 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -54.63 -36.88 64.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.398 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.99 -50.17 64.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.434 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.32 -28.0 69.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.696 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.27 32.25 3.53 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.188 -0.914 . . . . 0.0 112.383 179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.796 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -99.18 154.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.973 0.416 . . . . 0.0 110.724 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -81.54 92.51 6.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.004 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.596 ' HA ' HG22 ' A' ' 50' ' ' ILE . 93.5 p -79.69 155.25 28.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.123 0.487 . . . . 0.0 110.927 -178.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.635 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.39 140.92 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.822 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 42.3 t -118.59 118.17 57.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.118 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.577 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.103 0 CA-C-O 121.065 0.46 . . . . 0.0 110.561 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 30.6 m-85 . . . . . 0 C--O 1.231 0.119 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -109.22 151.18 26.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.161 0.505 . . . . 0.0 111.784 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.727 ' HB ' HD23 ' A' ' 26' ' ' LEU . 86.5 t -123.9 102.19 10.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.565 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.635 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -106.7 141.98 37.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.89 -179.267 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 123.1 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.61 0.719 . . . . 0.0 111.246 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.45 104.63 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.849 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.535 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -125.73 124.02 40.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.646 0.26 . . . . 0.0 110.666 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.04 174.36 10.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.036 0.446 . . . . 0.0 111.404 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -83.49 -16.7 44.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.74 130.59 56.41 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.977 0.418 . . . . 0.0 111.172 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.493 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.69 -34.66 67.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.164 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -52.34 -32.57 38.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 0.0 111.07 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.683 ' O ' HG22 ' A' ' 61' ' ' THR . 2.6 m120 -70.26 -48.45 56.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.693 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.614 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.24 -39.98 92.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.841 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -60.16 -51.78 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.683 HG22 ' O ' ' A' ' 58' ' ' ASN . 15.4 t -58.91 -34.75 72.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 0.0 110.855 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.4 -50.96 33.15 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.741 0.781 . . . . 0.0 110.049 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.0 -58.19 7.8 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.044 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.6 -35.46 65.84 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.65 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -63.96 -40.9 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 179.083 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.35 -40.07 95.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.451 178.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.0 mmmm -61.71 -47.24 86.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.719 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -26.34 65.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.809 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.51 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.67 -21.93 54.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.587 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.66 23.21 5.74 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.385 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.609 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.58 148.97 52.44 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 8.3 t0 -92.08 74.72 5.51 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.807 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.8 143.16 27.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.911 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -136.46 162.95 34.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.7 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.614 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.7 t -111.58 136.77 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.959 0.409 . . . . 0.0 111.013 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.12 -179.829 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mp . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.503 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -100.9 107.28 18.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.146 0.498 . . . . 0.0 110.018 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -127.2 155.74 42.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.596 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.1 137.58 38.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.2 179.829 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -130.36 133.3 46.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.336 . . . . 0.0 111.024 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.546 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -104.8 -4.79 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.67 174.73 28.76 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 119.05 -1.548 . . . . 0.0 114.674 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.759 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.34 140.37 21.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.548 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -144.75 148.84 34.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.834 0.35 . . . . 0.0 111.401 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -61.06 -14.42 23.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.448 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.2 t -107.17 128.94 61.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.092 0.472 . . . . 0.0 111.92 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.4 OUTLIER -68.72 -42.74 77.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.579 179.655 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.87 -32.04 60.33 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 109.852 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -77.45 -35.16 54.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.315 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.31 -18.97 61.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.771 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.81 -37.62 20.55 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.488 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.4 t -65.03 -37.0 86.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.98 HD12 ' OD1' ' A' ' 29' ' ' ASN . 33.7 tp -68.49 -50.41 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.198 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.45 -26.07 52.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -40.49 60.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.146 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.98 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.65 -48.71 80.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.919 0.39 . . . . 0.0 110.665 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.72 -39.06 90.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.359 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -54.67 -37.13 65.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.336 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.11 -49.59 68.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.425 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.0 mmtt -62.28 -28.3 69.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.29 32.88 3.09 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.473 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -101.82 159.08 15.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.983 0.421 . . . . 0.0 110.682 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -87.04 94.69 9.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.879 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.585 ' HA ' HG22 ' A' ' 50' ' ' ILE . 87.4 p -80.38 157.04 26.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.09 0.472 . . . . 0.0 110.818 -178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.91 141.69 6.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.771 -178.472 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.615 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 20.6 t -119.69 117.93 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.494 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.578 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.113 0 CA-C-O 120.874 0.369 . . . . 0.0 110.77 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.461 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.1 m-85 . . . . . 0 N--CA 1.461 0.078 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.759 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.08 147.79 27.51 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.17 0.509 . . . . 0.0 112.022 -179.473 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 93.7 t -120.67 101.64 11.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.362 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 11.3 tt0 -109.02 142.25 39.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.595 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.14 123.38 39.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.539 0.685 . . . . 0.0 111.5 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.24 105.64 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 114.827 -1.078 . . . . 0.0 113.054 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.57 116.36 19.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.778 0.323 . . . . 0.0 110.232 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.58 173.53 11.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.027 0.441 . . . . 0.0 111.604 -179.158 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.42 -17.85 40.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.07 131.92 56.21 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.888 0.375 . . . . 0.0 111.078 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.503 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -58.66 -38.96 79.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.397 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -44.98 -33.89 2.21 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.963 0.411 . . . . 0.0 110.782 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 8.7 m120 -72.47 -48.78 38.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.331 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.574 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.69 -45.23 85.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.001 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.33 -50.65 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.864 0.364 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 5.2 m -58.58 -36.18 73.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.61 34.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 121.709 0.766 . . . . 0.0 110.065 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.93 -59.54 4.59 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.026 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.96 -37.89 47.27 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.567 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.4 ttt180 -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.983 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.96 -42.93 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.776 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.46 -47.13 87.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.658 178.83 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -25.86 64.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.74 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.476 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.94 53.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.315 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.33 23.18 5.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.515 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.572 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.21 148.94 52.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.462 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.0 t70 -92.93 74.44 4.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.07 142.06 28.98 Favored 'General case' 0 CA--C 1.524 -0.029 0 CA-C-O 121.108 0.48 . . . . 0.0 111.751 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -133.4 149.91 31.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.03 179.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.574 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.6 t -102.72 136.27 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.895 0.379 . . . . 0.0 111.078 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.25 -179.973 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.407 ' HA ' HD13 ' A' ' 9' ' ' LEU . 3.1 mm? . . . . . 0 CA--C 1.515 -0.386 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 45.7 m-85 -101.62 106.35 17.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.058 0.456 . . . . 0.0 109.98 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 10.2 mttt -125.68 153.18 44.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.689 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.88 136.65 39.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.164 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -129.69 134.78 47.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.808 0.337 . . . . 0.0 111.163 -179.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.521 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.07 -6.16 10.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -178.754 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.44 173.06 29.61 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 118.792 -1.671 . . . . 0.0 114.944 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.17 137.52 18.52 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.467 178.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.9 m-85 -146.2 149.35 33.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.784 0.326 . . . . 0.0 111.058 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -59.69 -14.66 15.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.828 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.51 130.29 60.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.096 0.474 . . . . 0.0 112.049 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -72.23 -40.6 67.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.623 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.62 -34.18 57.62 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.303 0.573 . . . . 0.0 109.791 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -75.32 -32.67 61.02 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.212 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.39 -20.2 60.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.034 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -83.34 -38.48 22.0 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.681 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.86 -38.23 85.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.315 0.579 . . . . 0.0 109.646 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 48.6 tp -65.31 -51.1 62.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.149 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.539 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.98 -24.85 63.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.574 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.377 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.3 -46.93 87.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.426 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.36 -42.65 87.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.622 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -55.34 -37.28 67.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.311 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -52.54 -51.54 59.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.296 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 3.5 mmpt? -63.2 -28.97 70.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.21 33.28 2.79 Favored Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.528 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.95 160.14 14.75 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.925 0.393 . . . . 0.0 110.81 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -88.96 94.68 10.03 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.773 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -80.6 157.55 25.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.146 0.498 . . . . 0.0 110.861 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.7 140.16 5.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.724 -178.699 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 23' ' ' ALA . 21.4 t -115.11 112.51 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.282 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.631 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.239 0 CA-C-O 120.998 0.428 . . . . 0.0 110.714 179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.432 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 23.8 m-85 . . . . . 0 C--O 1.226 -0.179 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.27 155.51 29.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.967 0.413 . . . . 0.0 111.455 -179.558 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' A' ' 26' ' ' LEU . 59.3 t -125.21 109.91 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.959 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.48 ' HB3' HG23 ' A' ' 38' ' ' ILE . 32.9 tt0 -110.09 142.05 42.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.034 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.82 122.76 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 121.601 0.715 . . . . 0.0 111.525 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.0 105.0 0.32 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.826 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -128.41 113.31 15.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.696 0.284 . . . . 0.0 110.429 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -132.15 173.4 11.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.23 0.538 . . . . 0.0 111.389 -179.274 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -16.27 46.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.106 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.93 129.44 56.47 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.892 0.377 . . . . 0.0 111.094 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.4 OUTLIER -56.1 -35.36 66.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.25 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.9 -32.2 31.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.451 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 11.3 m120 -70.34 -49.83 45.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.558 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.3 -41.25 88.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.011 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -60.22 -50.86 72.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.7 0.285 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.8 m -59.0 -36.9 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.83 -51.43 40.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 121.834 0.826 . . . . 0.0 110.17 179.375 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.61 -60.3 3.53 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.211 -1.358 . . . . 0.0 111.124 -177.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -36.97 40.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.462 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -65.41 -39.3 91.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.835 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.7 -41.92 95.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.662 179.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.4 mttt -61.59 -46.65 88.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.698 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -69.74 -25.52 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.691 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.96 -22.72 52.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.402 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 24.14 5.42 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.545 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.52 148.29 52.3 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.02 72.48 5.55 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.852 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.81 141.39 30.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.1 0.476 . . . . 0.0 111.722 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 6.9 pt -133.61 152.22 34.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.007 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.602 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.9 t -103.39 136.2 37.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.867 0.365 . . . . 0.0 111.039 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.34 -179.731 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.2 mt . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -101.83 106.72 17.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.459 ' HD3' ' NE2' ' A' ' 49' ' ' GLN . 12.8 mttt -124.8 155.65 39.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.47 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.992 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.59 141.61 23.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.435 179.627 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.441 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 17.7 tt0 -134.47 134.43 41.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.729 0.3 . . . . 0.0 111.319 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.651 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.71 -5.11 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.235 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.14 172.08 27.99 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 119.071 -1.538 . . . . 0.0 114.82 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.814 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.29 145.51 25.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 178.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.493 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.1 m-85 -151.63 151.62 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.004 0.431 . . . . 0.0 111.33 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -60.45 -15.46 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.422 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.7 t -106.38 128.39 60.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.001 0.429 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.24 -40.46 74.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.3 -33.08 62.96 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.267 0.556 . . . . 0.0 109.739 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -75.97 -33.83 59.77 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.264 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.91 -22.75 61.44 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.775 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.71 -37.21 31.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.596 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -38.58 89.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.215 0.531 . . . . 0.0 109.758 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.929 HD12 ' OD1' ' A' ' 29' ' ' ASN . 15.2 tp -66.93 -47.28 72.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.23 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.782 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -60.27 -25.61 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 110.578 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -40.52 57.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.018 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.929 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -60.25 -48.4 81.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.339 . . . . 0.0 110.626 -179.924 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.5 -38.76 91.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.255 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -54.96 -36.58 65.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.278 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.62 73.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.229 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.3 -28.17 69.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 31.14 3.55 Favored Glycine 0 N--CA 1.442 -0.936 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.497 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -100.37 156.92 16.98 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.794 0.331 . . . . 0.0 110.711 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.83 95.41 9.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.999 179.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.782 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 19.1 p -80.24 155.85 27.14 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.201 0.524 . . . . 0.0 111.044 -178.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.657 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -155.47 139.88 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.548 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.8 t -117.87 116.3 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.543 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.615 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.333 -0.142 0 CA-C-O 120.864 0.364 . . . . 0.0 110.458 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 22.7 m-85 . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.769 0.319 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.32 149.4 28.7 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.107 0.48 . . . . 0.0 111.268 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.641 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.7 t -122.04 100.45 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.609 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.657 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.4 tt0 -104.75 142.01 35.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.78 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.03 122.76 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.438 0.637 . . . . 0.0 111.425 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.475 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 82.01 107.38 0.4 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.78 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.533 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -127.7 121.06 29.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.258 . . . . 0.0 110.584 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -141.19 172.31 12.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.111 0.481 . . . . 0.0 111.424 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -83.99 -16.22 44.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.221 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 m -111.63 127.49 55.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.84 0.352 . . . . 0.0 111.198 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -54.82 -36.49 65.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -52.97 -30.03 32.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.423 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -71.81 -49.61 37.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.639 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.471 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.41 -40.87 95.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.937 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.24 -50.7 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 m -58.38 -36.57 73.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.674 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.992 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -69.24 -50.04 50.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.746 0.784 . . . . 0.0 110.065 179.355 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.7 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.76 -59.22 4.9 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.284 -1.325 . . . . 0.0 111.135 -177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.49 -36.1 63.8 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.792 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -40.82 97.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.961 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.81 -39.22 93.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.495 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.8 mttm -62.66 -46.66 87.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.569 178.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -26.23 64.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.734 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.483 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.59 -22.26 54.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.508 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.7 23.15 5.75 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.592 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.33 148.56 52.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 10.0 t70 -91.93 74.63 5.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.752 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.86 142.0 29.2 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.151 0.5 . . . . 0.0 112.117 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -134.07 160.98 41.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.748 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.482 HG22 HG13 ' A' ' 12' ' ' VAL . 98.5 t -113.1 137.58 45.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.904 0.383 . . . . 0.0 111.072 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.2 pt . . . . . 0 C--O 1.236 0.392 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.454 -179.942 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 9' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.519 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.9 m-85 -102.35 106.08 16.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.119 0.485 . . . . 0.0 110.172 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.422 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 12.4 mttm -125.14 153.46 42.98 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.474 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.97 139.99 26.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.342 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -134.33 134.35 41.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.617 0.246 . . . . 0.0 111.236 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.4 -4.8 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.128 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.58 175.87 29.0 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 118.993 -1.575 . . . . 0.0 114.757 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.813 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.78 148.47 27.9 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.588 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.4 m-85 -152.76 151.88 31.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.959 0.409 . . . . 0.0 111.441 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.65 -14.82 22.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.421 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.46 127.76 64.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.143 0.497 . . . . 0.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.86 -38.21 73.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.344 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -33.57 67.94 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.172 0.511 . . . . 0.0 109.658 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -75.62 -33.5 60.51 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.115 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.74 -18.54 60.97 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.798 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.55 -36.96 21.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.478 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -38.05 84.19 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.81 HD12 ' ND2' ' A' ' 29' ' ' ASN . 49.0 tp -66.22 -51.6 56.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.105 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.67 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.23 -24.37 59.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.306 178.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -41.04 67.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.587 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.81 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.53 -46.95 87.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.45 179.66 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.45 -41.18 93.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.45 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -55.05 -36.86 66.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.55 -51.44 62.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.303 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.0 mmpt? -62.6 -28.61 70.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.55 32.83 2.83 Favored Glycine 0 N--CA 1.443 -0.854 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.585 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.9 m-85 -101.2 158.51 15.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.698 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -87.38 94.93 9.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.923 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.67 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 21.7 p -80.56 157.01 26.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.15 0.5 . . . . 0.0 110.972 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.552 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.59 141.08 6.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.643 -178.789 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.88 116.56 52.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.51 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.623 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.434 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 25.6 m-85 . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.83 146.81 31.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.065 0.459 . . . . 0.0 111.248 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.716 ' HB ' HD23 ' A' ' 26' ' ' LEU . 72.8 t -117.74 100.33 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.58 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.552 ' HB3' HG23 ' A' ' 38' ' ' ILE . 37.6 tt0 -104.89 140.37 38.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.136 -179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.34 123.07 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.562 0.696 . . . . 0.0 111.57 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.71 106.99 0.25 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 114.739 -1.119 . . . . 0.0 112.879 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.422 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -130.13 115.58 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 110.484 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -134.27 173.5 11.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.227 0.537 . . . . 0.0 111.495 -179.252 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.52 -16.35 45.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.157 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.02 129.2 56.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.829 0.347 . . . . 0.0 111.081 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.519 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.9 OUTLIER -56.25 -35.15 67.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.221 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -52.44 -30.8 31.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.449 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 27.9 m120 -71.86 -49.92 33.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.71 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.513 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.86 -41.24 91.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.28 -51.01 71.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.998 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.69 -34.81 73.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.94 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.32 -51.6 28.96 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.804 0.811 . . . . 0.0 109.892 179.425 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.762 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.49 -58.91 5.63 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.932 -178.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.32 -37.28 55.44 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.476 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -64.69 -38.93 92.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.823 178.834 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.13 96.3 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.553 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 48.0 mttm -61.85 -46.8 87.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.654 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.66 -25.68 64.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.818 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.483 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.79 -22.41 53.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.278 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.34 24.18 5.47 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.421 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.74 147.98 52.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 23.0 t70 -91.58 73.42 5.93 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.607 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -83.99 140.92 31.58 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.16 0.505 . . . . 0.0 111.859 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.646 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -132.07 150.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.88 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.513 HG22 ' HB1' ' A' ' 59' ' ' ALA . 89.6 t -104.12 134.83 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.848 0.356 . . . . 0.0 110.966 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.646 HG23 HD12 ' A' ' 74' ' ' ILE . 1.3 pt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.127 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 CA--C 1.514 -0.419 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.517 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.2 m-85 -101.76 106.53 17.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.177 0.513 . . . . 0.0 110.127 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -126.15 153.24 44.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.344 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.018 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.21 138.44 31.63 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.145 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.439 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 16.1 tt0 -132.12 133.38 44.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.717 0.294 . . . . 0.0 111.127 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.635 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -107.34 -4.97 10.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.275 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.56 171.04 28.24 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 119.152 -1.499 . . . . 0.0 115.034 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.873 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 144.46 24.89 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 178.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.454 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -152.84 151.05 29.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.534 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.46 -15.33 16.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.598 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.63 128.35 61.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.95 0.405 . . . . 0.0 111.8 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.47 -39.1 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.45 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -32.69 63.56 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -76.34 -32.89 58.92 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.183 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.648 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.99 -23.6 61.44 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.722 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -37.46 30.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.717 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -65.48 -38.9 91.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.237 0.541 . . . . 0.0 109.877 179.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.932 HD12 ' OD1' ' A' ' 29' ' ' ASN . 14.7 tp -66.99 -45.91 76.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.232 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -61.13 -26.25 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.058 0.456 . . . . 0.0 110.537 179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.69 -40.87 61.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.041 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.932 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.6 -48.43 81.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.758 0.313 . . . . 0.0 110.642 179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.957 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.25 -38.26 88.57 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.282 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -54.9 -37.02 65.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.232 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.72 67.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.423 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.35 -28.28 69.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.625 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.42 33.37 3.16 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.438 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -100.75 156.28 17.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.94 0.4 . . . . 0.0 110.779 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.02 94.51 8.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.84 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.557 ' HA ' HG22 ' A' ' 50' ' ' ILE . 91.9 p -80.23 155.51 27.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.206 0.527 . . . . 0.0 111.126 -178.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.645 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.62 137.7 7.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.717 -178.617 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.648 HG13 ' HB1' ' A' ' 23' ' ' ALA . 22.0 t -117.6 115.69 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.38 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.566 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.334 -0.091 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.5 m-85 . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.873 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.82 149.62 28.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.186 0.517 . . . . 0.0 111.412 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.573 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.6 t -122.54 99.37 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.445 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.645 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -104.66 142.22 35.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.984 -179.282 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.957 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 122.59 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 111.396 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.559 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.96 104.81 0.26 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 114.818 -1.083 . . . . 0.0 112.867 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.644 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -127.24 125.4 40.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -144.25 173.67 11.56 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.135 0.493 . . . . 0.0 111.574 -179.337 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 97.1 p -83.47 -16.59 45.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.062 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.42 129.74 56.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.886 0.374 . . . . 0.0 111.078 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.9 -34.85 68.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.237 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -51.52 -31.9 25.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.883 0.373 . . . . 0.0 111.134 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.464 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.0 m120 -71.68 -49.57 38.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.697 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.502 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.45 -43.32 96.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.44 -51.44 69.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.931 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 70.6 m -57.88 -37.15 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.878 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.018 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.77 -51.12 44.45 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.714 0.768 . . . . 0.0 110.304 179.555 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.74 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.02 -59.67 4.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.099 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.73 -36.6 57.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.507 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.26 -39.6 94.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.765 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.64 -40.46 95.49 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.533 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.7 mttm -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.588 178.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -68.58 -25.94 65.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.846 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.502 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.97 -22.26 53.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.5 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 23.13 5.88 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.418 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.564 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.34 148.96 52.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.379 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.475 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.6 t70 -92.63 74.67 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.958 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.37 140.67 30.58 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.105 0.478 . . . . 0.0 111.907 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 11.3 pt -132.89 150.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.969 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.502 HG22 ' HB1' ' A' ' 59' ' ' ALA . 99.3 t -103.91 136.83 35.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.077 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 C--O 1.236 0.374 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.347 -179.836 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.4 m-85 -101.5 106.62 17.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.088 0.47 . . . . 0.0 109.896 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -125.54 152.46 45.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.451 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.037 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.59 136.65 38.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.283 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -128.06 135.48 49.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.598 0.237 . . . . 0.0 111.111 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.668 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.32 -6.14 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.828 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.61 173.08 29.82 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 118.795 -1.669 . . . . 0.0 115.374 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.34 142.68 23.38 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 114.62 -0.79 . . . . 0.0 108.949 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.33 150.38 28.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.949 0.405 . . . . 0.0 111.331 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -59.89 -15.38 21.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.617 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -107.88 127.27 64.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.005 0.431 . . . . 0.0 111.826 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.33 -38.26 68.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.658 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.29 -34.92 61.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.249 0.547 . . . . 0.0 109.591 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -73.98 -32.37 63.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.124 178.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.443 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.78 -19.99 60.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.978 179.172 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -82.12 -38.72 24.35 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.733 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -36.75 79.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.245 0.545 . . . . 0.0 109.799 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.84 HD12 ' ND2' ' A' ' 29' ' ' ASN . 51.0 tp -65.52 -51.95 56.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.472 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.11 -28.48 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.123 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -41.7 85.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.617 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.84 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.8 -47.92 83.78 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.692 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.76 -42.1 88.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.673 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.9 -37.17 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.395 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.23 -51.11 63.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.344 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.521 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpt? -62.61 -28.76 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.3 32.78 2.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.488 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.723 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -102.11 159.82 15.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.959 0.409 . . . . 0.0 110.716 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -88.33 94.88 9.98 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.907 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.586 ' HA ' HG22 ' A' ' 50' ' ' ILE . 78.2 p -80.69 156.62 26.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.155 0.503 . . . . 0.0 110.91 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.92 135.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -112.06 112.04 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.111 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.857 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 26.2 m-85 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -119.08 156.52 29.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.986 0.422 . . . . 0.0 110.806 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.668 HG12 HD11 ' A' ' 14' ' ' ILE . 58.7 t -124.62 109.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.357 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' HG23 ' A' ' 38' ' ' ILE . 35.3 tt0 -107.41 140.99 39.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.473 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.71 122.95 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.536 0.684 . . . . 0.0 111.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.58 104.96 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.871 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.95 112.65 14.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -130.39 171.05 13.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.078 0.466 . . . . 0.0 111.472 -179.188 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 t -80.83 -17.75 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.032 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -113.16 130.92 56.05 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.81 0.338 . . . . 0.0 111.053 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.9 ttpt -57.08 -38.85 73.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.72 -31.38 2.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.099 0.476 . . . . 0.0 110.776 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 33.4 m120 -72.21 -49.76 32.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.319 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.726 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.87 -43.32 81.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.118 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.29 -49.61 76.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.861 0.362 . . . . 0.0 110.843 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.7 m -60.18 -35.43 75.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.037 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.29 -52.87 19.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.874 0.845 . . . . 0.0 110.147 179.371 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.761 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.48 -58.92 5.57 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.899 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.63 -37.76 51.68 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt-85 -65.29 -37.97 88.8 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.798 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.42 -42.5 92.42 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.783 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 18.6 mttm -61.54 -46.51 89.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.696 178.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.78 -25.34 63.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.658 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.478 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.39 -23.17 50.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.283 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.05 23.97 5.33 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.524 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.529 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.04 148.76 52.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 12.8 t70 -92.24 73.48 5.38 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.1 140.42 30.24 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.079 0.466 . . . . 0.0 111.681 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.51 HD12 HG23 ' A' ' 76' ' ' ILE . 1.0 OUTLIER -132.87 152.35 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.003 179.211 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.726 HG22 ' HB1' ' A' ' 59' ' ' ALA . 86.7 t -101.65 138.04 27.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.943 0.401 . . . . 0.0 111.051 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.51 HG23 HD12 ' A' ' 74' ' ' ILE . 7.0 pt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.252 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 CA--C 1.517 -0.323 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -101.39 106.29 17.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.016 0.436 . . . . 0.0 110.209 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.33 154.37 43.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.607 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.31 140.03 25.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.277 179.821 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.657 ' HB3' HD11 ' A' ' 74' ' ' ILE . 3.9 tt0 -132.09 136.95 47.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.743 0.306 . . . . 0.0 111.145 -179.13 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.51 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.97 -6.28 11.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -179.037 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.78 172.71 29.52 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.892 -1.623 . . . . 0.0 115.021 178.861 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.97 134.34 16.2 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 114.856 -0.672 . . . . 0.0 109.474 178.406 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.634 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -143.34 149.0 37.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -12.0 12.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.894 -179.925 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.55 129.06 63.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.951 0.405 . . . . 0.0 112.033 -179.558 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.4 ttpt -70.31 -41.53 73.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.684 179.794 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.38 -33.71 54.82 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.217 0.532 . . . . 0.0 109.803 179.2 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -76.48 -32.29 58.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.321 178.459 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.68 -21.18 60.34 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.98 179.416 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -83.68 -38.03 22.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.2 t -67.07 -37.21 83.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.187 0.518 . . . . 0.0 109.648 179.061 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 44.3 tp -66.98 -51.89 49.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.3 -24.3 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -72.44 -41.36 66.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.635 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.27 -46.93 87.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.532 179.696 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.54 -40.66 95.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -36.91 66.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.38 179.73 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.7 -51.42 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.31 179.457 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.63 -28.52 69.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.692 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.28 32.71 2.92 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.65 179.069 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.8 m-85 -100.71 156.48 17.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.56 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -85.3 94.54 8.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.655 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 29.5 p -80.03 155.54 27.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.919 -178.664 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.35 135.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.741 -178.587 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 23' ' ' ALA . 40.2 t -112.91 111.01 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.127 179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 121.013 0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.0 m-85 . . . . . 0 C--O 1.227 -0.118 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -117.14 155.39 29.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 111.409 -179.547 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.75 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.2 t -126.46 108.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.358 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 38' ' ' ILE . 3.1 tt0 -109.77 143.26 39.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.696 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.42 123.54 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.521 0.677 . . . . 0.0 111.746 179.799 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.472 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.77 104.18 0.26 Allowed Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.968 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.459 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -126.73 120.58 29.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.676 0.274 . . . . 0.0 110.32 179.363 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -139.17 171.36 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.033 0.444 . . . . 0.0 111.581 -179.114 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -80.97 -17.34 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.962 179.53 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.01 131.58 56.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.025 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.2 ttpt -57.8 -37.63 74.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -46.18 -32.77 3.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.041 0.448 . . . . 0.0 110.988 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.454 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 45.9 m-80 -71.83 -49.61 36.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.736 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.6 -44.18 85.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.206 179.581 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.79 -51.92 67.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.757 0.313 . . . . 0.0 111.192 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.59 -34.11 72.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.059 -179.871 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.92 -53.2 15.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.83 0.824 . . . . 0.0 110.138 179.561 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.752 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.75 -58.56 6.79 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.911 -178.041 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.37 -37.67 56.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.396 179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.0 ttt180 -64.64 -37.65 88.29 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.788 178.888 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.62 -42.29 91.71 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.721 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 20.7 mttt -61.53 -46.61 89.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.682 178.71 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -69.88 -25.32 63.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.481 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.459 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.6 -23.25 49.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.217 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.38 24.25 5.13 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.53 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.87 148.84 52.57 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.302 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 22.5 t0 -92.63 74.28 5.06 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.727 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 142.1 28.1 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.183 0.516 . . . . 0.0 111.705 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.768 ' O ' HD12 ' A' ' 74' ' ' ILE . 2.2 pp -134.72 153.57 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.801 178.899 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.736 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.6 t -101.12 136.53 32.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.946 0.403 . . . . 0.0 111.041 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.2 pt . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.39 -179.902 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 CA--C 1.514 -0.424 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.31 106.85 18.08 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.105 0.479 . . . . 0.0 110.085 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.7 mttp -126.78 154.18 44.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.446 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.025 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -109.28 135.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.141 179.701 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -127.68 138.14 52.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.542 0.21 . . . . 0.0 111.07 -179.356 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.612 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -108.16 -4.59 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.923 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.38 176.27 30.24 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 118.609 -1.758 . . . . 0.0 115.352 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.62 143.94 24.07 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.596 -0.802 . . . . 0.0 108.999 178.024 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.483 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.1 m-85 -152.95 144.07 23.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.954 0.407 . . . . 0.0 111.635 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -17.29 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.187 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.28 127.57 62.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.284 0.564 . . . . 0.0 112.175 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tmtt? -70.16 -41.78 73.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.634 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.03 -35.51 47.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.301 0.572 . . . . 0.0 109.763 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -74.47 -32.8 62.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.221 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.72 -27.36 63.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.81 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.83 -37.32 55.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -34.31 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.196 0.522 . . . . 0.0 109.877 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.99 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.0 tp -69.73 -51.98 29.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.465 179.566 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.408 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.95 -26.41 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.2 m -73.95 -40.81 62.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.104 179.766 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.99 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.3 -49.4 77.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.745 -179.926 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.936 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.85 -39.42 89.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.294 179.542 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.83 -36.21 64.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.2 179.59 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -50.13 68.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.268 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 2.1 mmtt -62.54 -28.61 69.97 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.731 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.54 33.56 2.87 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.609 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.7 m-85 -101.46 157.6 16.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 110.736 179.564 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.69 93.3 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.879 179.254 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.6 p -80.5 157.15 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.151 0.501 . . . . 0.0 111.136 -178.707 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.526 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.98 140.07 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.429 -178.768 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.498 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -118.5 116.61 51.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.565 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.588 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.616 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.3 m-85 . . . . . 0 C--O 1.225 -0.228 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.47 151.82 25.05 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.128 0.489 . . . . 0.0 111.496 -179.713 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.634 HG21 ' HB3' ' A' ' 26' ' ' LEU . 52.7 t -125.77 106.73 16.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.084 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.526 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.6 tt0 -105.66 141.08 37.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.936 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.6 123.59 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.524 0.678 . . . . 0.0 111.392 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.59 108.73 0.29 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 114.798 -1.092 . . . . 0.0 113.14 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.456 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.56 124.11 26.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.508 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -143.2 175.76 9.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 111.599 -179.18 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -84.52 -18.81 34.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.02 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.38 129.52 55.99 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.888 0.375 . . . . 0.0 111.084 -179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtm? -56.49 -36.87 69.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.52 -179.781 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -50.69 -31.69 17.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.865 0.364 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 14.7 m120 -71.34 -49.38 43.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.699 179.925 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG13 ' A' ' 75' ' ' VAL . . . -60.62 -43.21 97.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.128 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.66 -52.05 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 110.835 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.9 m -55.45 -39.87 70.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.025 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -66.86 -50.37 62.72 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.737 0.779 . . . . 0.0 110.59 179.608 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.696 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -52.03 -62.04 1.88 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.382 -177.739 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.87 -35.2 61.29 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.939 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.1 ttt180 -63.67 -40.59 97.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.003 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.06 -40.97 95.51 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.741 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.9 mttm -61.67 -47.56 84.8 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.653 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -68.7 -25.87 65.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.79 178.426 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.35 -22.13 52.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.584 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.35 23.78 5.62 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.586 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.546 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.0 149.89 52.41 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.294 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.504 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 9.2 t0 -92.3 73.75 5.33 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.961 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.3 140.09 29.89 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.042 0.448 . . . . 0.0 111.887 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.1 pt -133.7 153.14 36.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.891 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.665 HG22 HG13 ' A' ' 12' ' ' VAL . 89.3 t -105.77 138.6 30.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.005 0.431 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 pt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.405 -179.957 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 CA--C 1.516 -0.352 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.53 106.93 18.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.1 0.476 . . . . 0.0 110.017 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.1 mttt -127.98 155.32 44.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.45 137.82 38.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.364 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.452 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 60.9 tt0 -128.91 135.29 48.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.906 -179.436 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.599 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.79 -4.69 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -178.777 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.26 175.99 29.81 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.616 -1.754 . . . . 0.0 115.273 178.466 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.533 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.67 144.37 24.32 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.247 178.06 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.528 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -152.69 144.21 23.4 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.988 0.423 . . . . 0.0 111.51 -179.526 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -16.27 1.76 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.202 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -108.45 127.88 64.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 112.236 -179.289 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.3 ttpt -69.83 -42.03 74.16 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.636 179.588 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -35.28 49.53 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.183 0.515 . . . . 0.0 109.758 179.108 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -74.6 -33.08 62.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.303 178.398 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.511 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -70.76 -25.76 63.05 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.749 179.091 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.16 -36.63 47.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -66.48 -35.4 80.19 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.058 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.993 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.8 tp -69.02 -52.57 27.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.442 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.07 -25.96 47.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.482 . . . . 0.0 110.647 179.043 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.8 t -74.66 -40.4 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.993 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.64 -48.9 79.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.62 -179.883 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.945 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.16 -39.63 90.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.157 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.56 -36.1 63.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.279 179.588 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.67 -51.6 62.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.66 -28.72 70.11 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.746 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.03 34.82 2.47 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.662 178.964 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -101.83 159.07 15.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.911 0.386 . . . . 0.0 110.723 179.391 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.44 94.43 9.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.12 179.382 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.562 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.55 156.83 26.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.223 0.535 . . . . 0.0 110.965 -178.681 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.561 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -156.2 137.87 5.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.511 HG13 ' HB1' ' A' ' 23' ' ' ALA . 19.6 t -116.22 114.43 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.567 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.333 -0.142 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.58 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.533 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.0 m-85 . . . . . 0 C--O 1.225 -0.19 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.79 151.7 25.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.183 0.516 . . . . 0.0 111.512 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.675 ' HB ' HD23 ' A' ' 26' ' ' LEU . 51.0 t -125.45 105.53 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.068 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.561 ' HB3' HG23 ' A' ' 38' ' ' ILE . 7.5 tt0 -104.3 141.54 36.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.945 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.57 123.57 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.46 0.647 . . . . 0.0 111.593 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.528 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.37 107.38 0.23 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.208 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.487 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -131.96 123.46 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.529 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.34 175.16 9.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.176 0.512 . . . . 0.0 111.649 -179.224 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 p -83.43 -18.75 37.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.009 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.49 129.32 56.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.955 0.407 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -55.49 -35.9 66.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.258 -179.876 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -50.21 -32.62 16.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.453 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 9.5 m120 -70.79 -50.15 38.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.551 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.66 -44.72 93.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.169 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -57.57 -52.84 63.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 0.0 110.884 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 24.9 m -55.67 -38.94 70.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.908 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.02 -51.08 59.3 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.788 0.804 . . . . 0.0 110.475 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.661 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.24 -61.56 2.22 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.279 -177.573 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.81 -36.91 49.57 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -63.63 -39.54 94.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.859 179.141 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.94 -41.85 90.79 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.732 179.032 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.5 mttm -61.14 -48.27 82.39 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.626 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.18 -25.99 65.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.803 178.559 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.493 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.77 -21.04 52.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.497 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.34 24.21 5.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.518 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB2' ' HB1' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.35 149.81 52.4 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.162 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.5 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 46.3 t0 -92.8 73.61 4.92 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.965 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.85 139.28 31.41 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.06 0.457 . . . . 0.0 111.747 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.7 pt -132.82 149.76 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.161 179.089 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.551 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.4 t -101.88 137.22 30.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.93 0.395 . . . . 0.0 111.017 179.82 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.3 pt . . . . . 0 C--O 1.234 0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.237 -179.836 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.0 mt . . . . . 0 CA--C 1.516 -0.344 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.512 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -100.93 106.77 18.13 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.117 0.484 . . . . 0.0 110.058 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.98 154.78 42.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.591 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.99 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.48 138.84 33.32 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.151 179.706 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.435 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 6.7 tt0 -131.35 135.43 47.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.684 0.278 . . . . 0.0 110.985 -179.211 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.693 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -5.41 10.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.853 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.85 175.68 30.05 Favored Glycine 0 C--N 1.338 0.664 0 C-N-CA 118.772 -1.68 . . . . 0.0 115.285 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.61 142.95 23.41 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.046 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -153.06 144.17 23.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.015 0.436 . . . . 0.0 111.625 -179.348 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.93 -16.16 1.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.02 179.761 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.03 126.7 64.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.344 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 3.9 ttpt -69.39 -41.28 76.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.381 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.87 -34.28 53.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.249 0.547 . . . . 0.0 109.647 179.064 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.74 -33.09 62.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.161 178.355 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.9 -18.64 60.88 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.016 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.92 -38.62 20.83 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.67 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -67.52 -37.54 82.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.284 0.564 . . . . 0.0 109.524 178.96 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.846 HD12 ' ND2' ' A' ' 29' ' ' ASN . 54.3 tp -65.67 -51.91 55.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.992 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.501 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -59.06 -24.21 62.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.611 179.238 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.41 -40.55 70.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.28 179.45 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.846 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.76 -48.44 81.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.659 179.787 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.937 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.53 -42.81 88.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.519 -179.871 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -55.12 -37.23 66.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.151 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.13 -51.25 64.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.361 179.395 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 14.6 mmtt -62.64 -28.86 70.21 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.67 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.22 33.56 2.51 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.752 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -104.22 164.22 11.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.594 179.379 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.55 92.52 8.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.939 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.681 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -81.22 127.37 32.61 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.288 0.566 . . . . 0.0 111.178 -178.794 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -124.61 139.04 52.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.671 -179.217 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.9 t -116.04 113.11 42.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.196 179.934 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.809 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.514 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.8 m-85 . . . . . 0 N--CA 1.456 -0.135 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -109.76 151.78 26.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.42 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.693 HG12 HD11 ' A' ' 14' ' ' ILE . 67.5 t -124.03 105.41 15.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.011 179.792 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 8.4 tt0 -104.63 141.44 36.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.516 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.937 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.48 123.1 36.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.431 0.634 . . . . 0.0 111.668 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.39 108.13 0.35 Allowed Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.945 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.468 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -130.48 122.27 27.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.519 0.199 . . . . 0.0 110.468 179.586 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.47 172.64 12.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.47 . . . . 0.0 111.518 -179.295 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 t -82.87 -16.81 46.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.059 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.83 129.9 56.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.512 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.0 tmtt? -56.77 -35.31 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.264 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -50.32 -32.97 18.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 110.928 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.455 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 14.5 m120 -70.71 -49.59 45.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.725 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.46 -42.93 93.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.117 179.801 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -58.84 -52.15 66.97 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.106 -179.832 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -58.18 -35.79 72.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.921 -179.93 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.99 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.51 35.28 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 121.757 0.789 . . . . 0.0 110.188 179.561 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.72 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.62 -60.62 3.1 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.064 -177.829 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.85 51.55 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.663 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.6 ttt180 -63.1 -38.16 90.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.814 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.68 -41.99 91.78 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.723 179.085 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 43.4 mttm -61.39 -47.59 85.13 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.621 178.727 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -68.91 -25.44 64.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.69 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.43 -21.96 52.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.392 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.78 24.2 5.63 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.375 -179.34 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.542 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.78 149.09 52.58 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -179.214 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.6 t70 -92.25 71.89 5.33 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.695 179.827 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.25 141.39 30.14 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-O 121.09 0.471 . . . . 0.0 111.731 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.08 152.62 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.572 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.0 t -104.73 135.19 43.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.875 0.369 . . . . 0.0 110.953 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.36 -179.953 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 CA--C 1.515 -0.367 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.523 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.8 m-85 -101.25 107.28 18.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.109 0.48 . . . . 0.0 109.974 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.3 mttm -126.08 155.37 41.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.4 179.802 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.999 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.07 137.49 40.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.212 179.811 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tt0 -128.44 133.4 48.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.675 0.274 . . . . 0.0 111.409 -179.357 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.935 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -98.6 -5.61 9.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.13 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 151.31 -176.49 29.75 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 119.037 -1.554 . . . . 0.0 114.813 178.458 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.534 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -152.35 144.41 23.81 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.929 -0.636 . . . . 0.0 109.428 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.501 ' HE2' HD22 ' A' ' 26' ' ' LEU . 16.7 m-85 -153.22 141.89 20.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.914 0.388 . . . . 0.0 111.532 -179.595 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -15.57 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.892 179.793 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.35 123.31 62.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.076 0.465 . . . . 0.0 112.165 -179.224 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -67.19 -41.03 86.55 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.23 179.262 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.43 -31.89 47.33 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.205 0.526 . . . . 0.0 109.704 178.971 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -76.42 -32.38 58.44 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.263 178.336 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -77.21 -17.25 58.64 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.095 179.086 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -84.47 -38.68 19.84 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.339 0.59 . . . . 0.0 109.719 178.917 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.726 HD12 ' ND2' ' A' ' 29' ' ' ASN . 12.0 tp -66.86 -56.89 8.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.482 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.676 ' HB2' HG13 ' A' ' 48' ' ' VAL . . . -56.75 -33.66 66.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.149 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 m -61.27 -40.88 95.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.41 179.614 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.726 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -61.38 -43.38 98.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.45 179.655 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.95 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.39 -41.98 98.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.11 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -55.04 -35.99 65.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.137 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.4 -51.48 64.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.277 179.371 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 8.5 mmtt -62.63 -28.55 69.98 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.695 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.9 33.46 2.6 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.3 -0.863 . . . . 0.0 112.775 178.941 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.6 m-85 -102.37 158.92 15.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.917 0.389 . . . . 0.0 110.904 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.56 92.72 8.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.738 179.22 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 16.1 p -80.69 158.52 25.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.191 0.519 . . . . 0.0 111.339 -178.642 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.82 141.71 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.479 -178.818 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.419 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.6 t -118.84 115.84 49.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.513 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.59 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.455 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.9 m-85 . . . . . 0 C--O 1.226 -0.171 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.74 148.94 27.83 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.238 0.542 . . . . 0.0 111.752 -179.362 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.935 HG12 HD11 ' A' ' 14' ' ' ILE . 61.9 t -120.31 106.17 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.919 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.544 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.3 tt0 -105.57 139.89 39.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.001 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.95 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.88 124.03 36.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.459 0.647 . . . . 0.0 111.64 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.21 108.99 0.28 Allowed Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.197 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.445 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.12 115.49 15.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.682 0.277 . . . . 0.0 110.425 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.55 175.93 8.99 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.057 0.456 . . . . 0.0 111.564 -179.256 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 p -84.56 -18.29 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.023 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.43 128.71 56.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.865 0.364 . . . . 0.0 111.105 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.5 tmtm? -55.59 -36.42 66.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.259 -179.907 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -51.65 -32.01 27.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 4.1 m120 -70.67 -49.5 46.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.77 -41.66 91.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.082 179.656 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -59.14 -51.5 69.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.994 -179.912 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -36.71 71.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.832 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.999 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.46 -50.64 43.58 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.667 0.746 . . . . 0.0 110.15 179.543 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.753 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.44 -60.57 3.14 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.06 -177.86 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.66 -37.42 58.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.709 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -63.82 -38.51 91.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 0.0 109.804 179.031 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.3 -41.75 93.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.759 179.114 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.1 OUTLIER -62.0 -46.5 88.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.614 178.841 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.88 -25.79 64.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.642 178.253 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.85 -21.95 54.26 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.266 179.608 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.01 24.12 5.87 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.936 -0.649 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.527 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 0.9 OUTLIER -130.56 152.14 50.26 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.139 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 17.9 t70 -94.47 71.35 3.71 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.949 -0.301 . . . . 0.0 111.199 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -88.81 140.5 29.38 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 121.062 0.458 . . . . 0.0 111.667 179.654 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 13.7 pt -134.21 157.66 41.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.837 179.259 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 97.1 t -105.23 137.24 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.918 0.389 . . . . 0.0 111.158 179.888 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.393 -179.869 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.7 mt . . . . . 0 CA--C 1.517 -0.322 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.7 m-85 -101.4 106.8 17.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.011 0.434 . . . . 0.0 109.86 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.83 153.5 46.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.495 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.078 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.82 139.26 27.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.388 -179.942 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -130.42 137.52 49.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.586 0.232 . . . . 0.0 111.222 -179.165 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.701 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -109.92 -6.23 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.89 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.59 175.02 30.08 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 118.713 -1.708 . . . . 0.0 115.355 178.653 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.498 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.44 145.37 25.18 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.554 -0.823 . . . . 0.0 109.031 178.141 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.28 148.22 26.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 111.611 -179.188 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -55.61 -17.23 5.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.732 179.703 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.6 t -108.65 129.88 62.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.019 0.438 . . . . 0.0 111.948 -179.487 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -73.74 -37.68 65.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.312 179.612 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.43 64.23 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.297 0.57 . . . . 0.0 109.527 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -72.99 -32.15 64.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.986 178.107 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.44 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.4 -20.0 60.85 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.805 179.055 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -82.11 -37.33 26.46 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.726 179.835 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.5 t -69.35 -35.93 76.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.796 179.037 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.844 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -66.39 -51.75 53.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.358 179.393 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.614 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.75 -27.85 65.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.097 0.475 . . . . 0.0 110.417 179.072 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 t -67.7 -41.58 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.599 179.529 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.844 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.06 -47.63 85.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.622 179.651 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.902 ' HB1' HG21 ' A' ' 50' ' ' ILE . . . -60.64 -41.77 95.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.525 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -54.54 -36.36 64.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.244 179.587 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.41 -51.4 65.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.9 mmtt -62.67 -28.81 70.18 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.678 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.01 34.63 2.52 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.636 178.98 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.72 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -102.66 159.44 15.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.899 0.381 . . . . 0.0 110.802 179.631 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -87.6 93.82 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.252 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.614 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 41.2 p -79.02 152.87 30.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.973 -178.957 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.612 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -152.29 135.0 6.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 12.0 t -111.87 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.32 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.674 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' HD2' HG12 ' A' ' 39' ' ' VAL . 25.5 m-85 . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -116.27 154.08 30.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.983 0.42 . . . . 0.0 111.067 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.701 HG12 HD11 ' A' ' 14' ' ' ILE . 91.7 t -122.95 117.51 52.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.976 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.612 ' HB3' HG23 ' A' ' 38' ' ' ILE . 10.1 tt0 -119.15 143.99 46.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.344 -179.136 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.902 HG21 ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -137.28 140.87 41.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.971 178.993 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.469 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 69.38 97.14 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.971 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.89 112.52 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.166 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -135.89 171.05 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 111.633 -178.802 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -79.44 -16.42 56.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.767 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.01 132.14 56.69 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.913 0.387 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.8 ttpt -58.48 -36.74 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -46.71 -32.76 3.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.462 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 5.5 m120 -71.75 -50.08 33.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.609 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.2 -43.31 82.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.02 179.523 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.58 -51.17 71.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -57.93 -38.57 76.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.848 179.957 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.078 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.82 -52.23 39.34 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.727 0.775 . . . . 0.0 110.395 179.509 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.671 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.04 -60.73 2.91 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.18 -177.808 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.95 -36.39 49.14 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.467 179.48 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.54 -39.89 92.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.047 179.035 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.82 -41.52 95.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.591 179.113 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.4 mttm -61.87 -47.31 85.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.661 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -69.43 -25.12 63.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.703 178.637 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.497 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.63 -22.11 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.299 179.85 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.33 23.09 5.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.843 -0.694 . . . . 0.0 111.418 -179.478 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.14 148.14 51.95 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -179.248 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.442 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -91.8 74.43 5.73 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.772 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.81 140.92 29.22 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.129 0.49 . . . . 0.0 111.855 179.981 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.623 HD12 HG23 ' A' ' 76' ' ' ILE . 1.9 pp -133.49 151.46 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.957 179.196 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.609 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.7 t -101.54 136.22 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.846 0.355 . . . . 0.0 110.955 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.623 HG23 HD12 ' A' ' 74' ' ' ILE . 18.6 pt . . . . . 0 C--O 1.236 0.369 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.244 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 CA--C 1.517 -0.295 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.5 m-85 -101.28 106.01 17.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.115 0.483 . . . . 0.0 110.163 179.681 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.46 153.38 43.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.359 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.004 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.55 141.55 20.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.379 179.84 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -133.73 132.74 40.95 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.728 0.299 . . . . 0.0 111.243 -178.945 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.559 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.08 -5.9 10.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.057 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.96 173.02 29.06 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 118.951 -1.595 . . . . 0.0 114.778 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.53 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.03 137.26 18.42 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 114.986 -0.607 . . . . 0.0 109.625 178.45 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.596 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.3 m-85 -146.29 150.54 35.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.873 0.368 . . . . 0.0 111.102 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -61.31 -12.91 15.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.937 -179.87 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.36 129.46 62.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.011 0.434 . . . . 0.0 111.965 -179.402 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 ttpt -71.4 -40.1 70.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.579 179.772 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.15 -33.62 58.42 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -76.48 -32.03 58.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.354 178.349 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.613 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.04 -20.6 60.25 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.999 179.271 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.91 -38.47 21.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.693 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -67.34 -36.71 81.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 109.696 179.104 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -67.2 -51.57 51.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.253 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.573 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.57 -24.4 60.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.369 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -41.66 67.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.559 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.13 -47.06 86.67 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.391 179.816 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.74 -40.76 93.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.668 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -55.13 -36.91 66.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.203 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -51.35 62.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.24 179.422 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.542 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.48 -28.6 69.94 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.673 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.06 32.35 3.07 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.542 179.111 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.792 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.5 156.77 17.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.897 0.38 . . . . 0.0 110.776 179.506 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.27 93.63 8.73 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.66 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.626 ' HA ' HG22 ' A' ' 50' ' ' ILE . 54.1 p -80.16 156.76 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.076 0.465 . . . . 0.0 111.107 -178.638 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.13 139.13 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.716 -178.641 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.613 HG13 ' HB1' ' A' ' 23' ' ' ALA . 24.0 t -113.75 110.72 33.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.18 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.192 0 CA-C-O 121.008 0.432 . . . . 0.0 110.663 179.798 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' ' N ' ' A' ' 17' ' ' PHE . 26.1 m-85 . . . . . 0 C--O 1.228 -0.034 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.49 157.18 29.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.031 0.443 . . . . 0.0 111.338 -179.836 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.707 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.5 t -124.67 110.99 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.407 -179.701 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.1 tt0 -110.24 141.01 43.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.422 179.821 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.11 123.1 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.45 0.643 . . . . 0.0 111.652 179.702 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.527 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.13 100.13 0.3 Allowed Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.9 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.25 123.18 40.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.369 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -142.8 170.25 16.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.122 0.486 . . . . 0.0 111.501 -179.112 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.5 p -80.47 -16.4 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.903 179.537 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.55 131.05 56.79 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.893 0.378 . . . . 0.0 110.95 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 19.5 ttpp -57.52 -36.74 71.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.404 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -46.43 -32.17 3.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.977 0.418 . . . . 0.0 110.917 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.584 ' O ' HG22 ' A' ' 61' ' ' THR . 7.9 m120 -73.79 -48.7 29.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.356 179.647 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.579 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.78 -45.62 91.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.132 179.653 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -59.07 -53.07 62.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.702 0.287 . . . . 0.0 111.22 -179.649 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.584 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.8 t -58.87 -34.4 71.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.938 0.399 . . . . 0.0 111.034 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.004 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.85 -52.95 20.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.87 0.843 . . . . 0.0 110.195 179.522 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.745 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.73 -58.49 7.01 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.97 -177.934 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.96 -37.28 60.99 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.468 179.55 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.2 ttt180 -64.16 -39.06 93.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.764 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.03 -40.44 96.33 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.45 179.075 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.02 91.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.556 178.741 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -70.25 -25.51 63.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.878 178.58 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -77.17 -22.96 51.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.374 179.784 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.31 23.67 5.38 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.547 -179.313 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.547 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.22 148.28 52.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 -179.245 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.3 t0 -92.31 73.72 5.32 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.779 179.594 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.96 142.86 29.34 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.082 0.468 . . . . 0.0 111.806 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.2 pt -134.66 153.06 34.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.579 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.1 t -103.75 135.38 41.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 111.073 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.225 -179.909 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.516 -0.339 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.3 m-85 -101.76 106.97 18.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.163 0.506 . . . . 0.0 109.937 179.582 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.402 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.3 mttt -125.93 152.88 45.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.349 179.784 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.011 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.23 142.57 17.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.171 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -135.51 134.19 39.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.853 0.359 . . . . 0.0 111.423 -178.911 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.531 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.23 -5.65 10.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -179.328 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.78 173.97 27.88 Favored Glycine 0 C--N 1.338 0.672 0 C-N-CA 119.215 -1.469 . . . . 0.0 114.421 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.761 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 147.95 27.36 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.092 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.566 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -152.22 151.64 31.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 111.268 -179.384 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -60.89 -14.36 21.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.345 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.93 128.43 61.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.955 0.407 . . . . 0.0 111.76 -179.75 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.8 -36.86 70.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.247 179.639 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.16 -32.6 70.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 109.779 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -76.98 -34.33 57.56 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.109 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.54 -19.39 61.52 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.659 178.978 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -83.73 -38.29 21.57 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.345 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.0 t -65.28 -37.03 85.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.309 0.576 . . . . 0.0 109.644 178.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.931 HD12 ' OD1' ' A' ' 29' ' ' ASN . 40.3 tp -67.91 -48.7 65.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.137 179.172 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.62 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -57.35 -26.22 60.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.143 0.497 . . . . 0.0 110.369 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.24 -40.45 62.39 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.07 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.931 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.32 -48.55 81.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.939 0.4 . . . . 0.0 110.633 -179.977 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.956 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.46 -38.35 89.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.84 -36.64 65.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.416 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.71 -51.42 60.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.524 179.546 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.34 -28.04 69.48 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.804 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.28 33.63 2.91 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.491 179.025 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.801 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.0 157.96 16.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.687 179.356 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.37 95.92 9.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.144 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.62 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 54.7 p -80.36 155.2 27.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.17 0.51 . . . . 0.0 110.973 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.66 139.96 8.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.783 -178.643 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.594 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.34 116.4 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.497 -179.712 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.606 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.904 0.383 . . . . 0.0 110.337 179.795 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.452 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 27.4 m-85 . . . . . 0 N--CA 1.457 -0.118 0 CA-C-O 120.736 0.303 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.761 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.71 148.42 30.48 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 120.996 0.427 . . . . 0.0 111.114 -179.912 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.73 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.0 t -120.03 99.08 6.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.648 179.606 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.8 OUTLIER -102.56 140.84 36.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.701 -179.62 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.956 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.01 123.05 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 111.324 179.623 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.28 103.56 0.2 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.819 179.897 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -125.43 124.41 41.4 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.35 174.38 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.088 0.471 . . . . 0.0 111.606 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.17 -17.27 43.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.984 179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.6 t -112.6 128.73 56.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtt? -56.68 -34.69 67.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.225 -179.881 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.51 -32.66 28.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.853 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 31.2 m120 -70.49 -49.52 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.65 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.585 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.2 -41.56 88.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.91 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.95 -51.15 70.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.8 0.333 . . . . 0.0 110.804 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.0 m -58.66 -35.89 73.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 -180.0 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.011 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.07 -51.56 30.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.766 0.793 . . . . 0.0 110.161 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.743 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.65 -58.49 7.01 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.938 -177.993 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -36.76 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.02 -38.87 92.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.559 178.937 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.18 -40.75 94.67 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.476 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.9 mttm -62.07 -47.21 85.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.624 178.749 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -68.68 -25.89 65.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.66 178.52 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.11 -21.94 53.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.394 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.07 23.45 5.82 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.409 -179.234 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.86 148.55 52.64 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.354 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -92.21 74.52 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.08 142.29 28.81 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.082 0.468 . . . . 0.0 112.003 179.89 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 10.1 pt -135.53 153.09 32.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.062 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.3 t -103.04 135.94 38.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.903 0.382 . . . . 0.0 110.914 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 C--O 1.236 0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.153 -179.866 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.6 mt . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.491 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -101.04 106.73 18.04 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.423 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -126.51 155.85 41.69 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.532 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.056 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.68 138.28 34.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.29 179.845 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -130.49 134.98 47.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.767 0.318 . . . . 0.0 111.104 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.559 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.27 -5.25 10.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.145 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.62 171.15 28.45 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 119.15 -1.5 . . . . 0.0 114.687 179.003 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.62 140.95 22.33 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.476 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.526 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.6 m-85 -149.85 149.62 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.0 111.361 -179.323 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -15.41 23.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.525 179.843 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -104.93 128.66 58.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.041 0.448 . . . . 0.0 111.765 -179.711 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.84 -38.92 70.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.452 179.772 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -32.39 65.24 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.168 0.509 . . . . 0.0 109.85 179.153 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.68 -33.86 53.15 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.25 178.511 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.53 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.8 -22.48 61.57 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.806 179.116 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -81.66 -38.83 25.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -64.0 -37.54 87.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.319 0.58 . . . . 0.0 109.72 179.021 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.959 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.5 tp -67.62 -46.33 72.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.206 179.357 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.538 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.49 -26.35 65.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.119 0.485 . . . . 0.0 110.631 179.187 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -74.82 -40.62 60.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.071 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.959 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.72 -48.58 81.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.911 0.386 . . . . 0.0 110.747 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.61 -38.3 89.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.333 179.472 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -55.18 -36.61 66.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.481 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.5 -50.29 65.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.388 179.442 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 6.1 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.709 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 32.65 3.1 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.554 179.058 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.2 m-85 -100.89 156.8 17.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.93 0.395 . . . . 0.0 110.72 179.639 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.52 94.19 8.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.009 179.422 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.57 ' HA ' HG22 ' A' ' 50' ' ' ILE . 86.3 p -80.24 155.98 27.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.114 0.483 . . . . 0.0 110.968 -178.815 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.568 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.22 142.33 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.761 -178.525 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 35.4 t -120.21 117.86 54.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.366 -179.759 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.589 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.981 0.42 . . . . 0.0 110.572 179.681 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 31.0 m-85 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.669 0.271 . . . . 0.0 110.324 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.816 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.48 149.45 27.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.983 0.421 . . . . 0.0 111.528 -179.85 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.814 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.9 t -121.81 100.97 9.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.29 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -106.84 141.9 37.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.543 -178.831 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.78 123.48 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-O 121.469 0.652 . . . . 0.0 111.414 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.69 105.33 0.25 Allowed Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.004 179.671 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.44 115.49 18.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.628 0.252 . . . . 0.0 110.429 179.525 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.56 171.04 14.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.045 0.45 . . . . 0.0 111.544 -179.328 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.99 -18.33 50.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.02 133.05 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.934 0.397 . . . . 0.0 111.089 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.491 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 7.7 ttpt -58.82 -38.27 78.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.443 -179.708 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.01 -32.23 2.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.998 0.427 . . . . 0.0 110.839 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.45 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 32.7 m120 -72.52 -49.23 34.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.413 179.638 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.637 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.97 -44.66 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.255 179.657 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -59.17 -50.78 72.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 4.6 m -58.9 -36.23 74.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.793 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.056 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.34 -51.69 34.48 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.808 0.813 . . . . 0.0 110.293 179.446 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.1 -59.25 4.9 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.039 -177.983 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.41 -36.17 53.55 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.37 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.6 ttt180 -65.29 -38.95 91.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.727 178.885 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.72 -41.69 91.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.645 178.965 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.577 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.87 87.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.165 0.507 . . . . 0.0 109.662 178.773 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -69.34 -25.77 64.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.753 178.534 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.9 -22.65 53.08 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.91 23.9 5.41 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.481 -179.303 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.577 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.81 148.73 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.325 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.465 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.3 t0 -92.54 75.41 5.11 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.936 179.965 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.55 141.4 29.07 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 121.228 0.537 . . . . 0.0 111.931 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.6 pt -133.68 151.02 32.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.984 179.122 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.637 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.2 t -101.33 137.88 27.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.938 0.399 . . . . 0.0 111.03 -179.944 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 pt . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.179 -179.936 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt . . . . . 0 CA--C 1.516 -0.337 0 CA-C-O 120.878 0.371 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.7 m-85 -101.69 106.25 17.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.838 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.485 ' HD3' ' NE2' ' A' ' 49' ' ' GLN . 19.1 mttt -125.11 152.32 44.55 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.473 179.846 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.041 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.17 139.87 24.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.197 179.712 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -132.61 134.56 45.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.792 0.33 . . . . 0.0 111.282 -179.135 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.578 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.77 -5.74 10.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.234 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.13 172.62 27.6 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 119.18 -1.486 . . . . 0.0 114.707 178.884 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.773 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.54 147.95 27.42 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.025 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.545 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.3 m-85 -152.21 153.11 33.16 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.485 -179.293 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -59.8 -17.29 34.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.295 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.04 130.63 57.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.046 0.45 . . . . 0.0 111.915 -179.394 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -72.92 -38.21 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.231 179.515 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.18 66.24 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.893 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -75.46 -33.61 60.86 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.099 178.22 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.567 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.33 -20.81 61.42 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.649 179.054 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.4 -37.48 25.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.47 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.5 t -66.19 -37.23 85.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.772 179.085 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.935 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.19 -47.06 68.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.259 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.674 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.87 -26.07 65.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.055 0.455 . . . . 0.0 110.349 178.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.54 61.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.091 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.935 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.64 -48.34 82.05 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 120.863 0.363 . . . . 0.0 110.616 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.58 -38.33 89.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.243 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -54.74 -36.61 64.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.387 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.67 -51.22 61.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.472 179.483 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.45 -28.2 69.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.73 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.44 33.24 2.97 Favored Glycine 0 N--CA 1.444 -0.775 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.44 179.025 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.732 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.9 m-85 -100.47 156.93 17.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.917 0.389 . . . . 0.0 110.628 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.96 95.21 8.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.935 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.674 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 51.5 p -80.14 155.01 27.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.174 0.512 . . . . 0.0 110.88 -178.801 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.55 139.34 8.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 -178.47 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.61 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.3 t -117.13 116.04 50.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.505 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.624 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.875 0.369 . . . . 0.0 110.436 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 27.8 m-85 . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.773 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.22 148.97 29.19 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 111.266 -179.749 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.745 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.9 t -121.62 99.41 7.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.579 179.666 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.619 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.3 tt0 -104.02 142.25 34.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.907 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.39 123.25 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.623 0.725 . . . . 0.0 111.281 179.423 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.13 101.62 0.23 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.768 -1.106 . . . . 0.0 112.888 179.726 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.451 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -124.99 116.42 22.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.664 0.269 . . . . 0.0 110.399 179.493 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.29 171.09 14.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.084 0.469 . . . . 0.0 111.637 -179.209 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.4 p -80.43 -17.86 50.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.956 179.556 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -113.41 131.75 55.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.947 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 14.7 ttpt -57.64 -39.35 76.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.488 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -45.88 -32.1 2.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.02 0.438 . . . . 0.0 110.927 -179.85 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 34.9 m120 -72.15 -49.41 36.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.308 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.628 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.49 -43.86 84.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.066 179.645 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.11 -49.81 76.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.872 0.368 . . . . 0.0 110.933 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.46 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.8 m -59.46 -36.06 75.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.041 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.0 -52.74 21.71 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 121.792 0.806 . . . . 0.0 110.282 179.479 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.742 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.98 -58.22 8.12 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.982 -177.917 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.89 -37.0 60.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.348 179.361 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.74 -39.79 94.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.715 179.016 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.69 -40.93 96.23 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.572 179.009 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.3 OUTLIER -62.13 -46.99 86.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.562 178.834 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -69.44 -25.57 64.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.791 178.618 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.82 -22.6 53.37 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.459 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 23.49 5.66 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 -179.325 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.555 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.66 148.4 52.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.386 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.6 t70 -91.98 74.65 5.59 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.79 140.39 30.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.085 0.469 . . . . 0.0 111.88 179.962 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.429 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.4 pt -132.66 151.97 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.925 179.098 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.628 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.3 t -102.61 137.14 31.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.893 0.378 . . . . 0.0 111.114 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.962 -179.877 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 tp . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.764 0.316 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 mttt 59.84 104.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.0 155.26 29.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.823 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.0 m 62.73 119.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.847 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.0 p -71.57 134.62 46.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.84 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.8 m -106.32 115.78 30.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.979 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -166.14 91.62 0.47 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.539 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 85.62 156.69 27.44 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.545 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.2 mt -143.61 139.82 29.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.1 m-85 -101.79 105.91 16.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.069 0.461 . . . . 0.0 110.186 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 19.0 mttt -125.21 151.91 45.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.332 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -103.85 142.62 17.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.184 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -136.33 131.94 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.863 0.363 . . . . 0.0 111.342 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.536 HD13 HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -105.36 -5.46 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.69 173.54 28.3 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 119.236 -1.459 . . . . 0.0 114.43 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.725 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.41 142.74 23.38 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.605 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -147.75 150.62 34.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.038 0.447 . . . . 0.0 111.405 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' HG3' HD23 ' A' ' 45' ' ' LEU . 8.0 ttmt -60.54 -15.07 23.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.415 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.4 t -106.54 129.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 121.112 0.482 . . . . 0.0 111.785 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.2 ttpt -71.88 -39.17 69.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.512 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.72 -32.0 66.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.132 0.491 . . . . 0.0 109.827 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -77.51 -34.43 54.04 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.259 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -19.49 60.98 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.839 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.67 -38.34 21.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -38.03 88.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.803 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.5 tp -65.95 -50.06 65.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.217 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.54 -24.32 60.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.485 179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.85 -41.5 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.612 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.803 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -58.68 -47.38 84.68 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.513 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.51 -40.29 94.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.522 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.71 -37.31 65.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.304 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.32 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.36 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -62.5 -28.48 69.87 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.66 32.92 3.0 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.54 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.799 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -100.35 155.88 17.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -85.02 94.51 8.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.8 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.591 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.6 p -80.17 156.0 27.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.175 0.512 . . . . 0.0 111.017 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.66 137.71 7.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.913 -178.584 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 47.5 t -114.98 113.86 44.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.028 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.836 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -112.87 125.27 54.18 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.006 0.431 . . . . 0.0 110.499 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.836 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -88.07 114.04 24.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.319 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.663 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -98.7 166.82 11.14 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.474 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 12.4 t70 -55.18 66.94 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.9 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.98 -23.93 3.48 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 120.135 -1.031 . . . . 0.0 115.036 178.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 44' ' ' GLY . 20.1 mt -143.4 166.21 25.4 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.163 0.982 . . . . 0.0 112.744 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' OH ' HD22 ' A' ' 41' ' ' LEU . 27.9 m-85 -112.97 134.18 54.6 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.454 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.725 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.88 148.24 29.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.129 0.49 . . . . 0.0 111.815 -179.243 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.743 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.2 t -120.77 101.62 10.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.787 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.646 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.9 tt0 -107.5 142.19 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.864 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.13 123.07 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.518 0.675 . . . . 0.0 111.449 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.552 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.11 105.57 0.22 Allowed Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.865 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.571 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.1 124.87 40.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.647 0.261 . . . . 0.0 110.505 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.69 172.99 11.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.136 0.493 . . . . 0.0 111.499 -179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -83.04 -15.92 49.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.997 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 128.52 56.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.898 0.38 . . . . 0.0 111.028 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -56.32 -34.92 67.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.212 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.48 -30.88 32.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.443 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 33.7 m120 -70.8 -50.24 37.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.681 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.599 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.75 -40.2 87.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.926 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -60.47 -51.47 69.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -59.02 -35.98 74.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.63 -52.04 29.52 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.846 0.831 . . . . 0.0 110.131 179.518 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.69 -59.05 5.11 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.993 -177.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.6 -36.75 56.9 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.522 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.5 ttt180 -64.33 -38.72 92.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.766 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.94 -40.88 95.71 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.543 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.9 mttm -61.86 -46.88 87.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.678 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.52 -25.69 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.817 178.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.475 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.08 -22.54 52.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.4 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.1 23.93 5.34 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.581 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.41 148.46 52.66 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.6 t70 -92.33 74.32 5.3 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.579 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.33 142.9 29.85 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-O 121.234 0.54 . . . . 0.0 111.845 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.51 152.74 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.016 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.8 t -104.91 134.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.902 0.382 . . . . 0.0 110.848 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.5 tt -135.68 139.24 46.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.286 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.539 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.2 tp -96.74 104.44 16.44 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.139 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -104.7 129.06 52.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.842 0.353 . . . . 0.0 111.305 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.904 179.906 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.859 0.361 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.79 170.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.969 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -123.02 176.7 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.859 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.3 p -110.02 142.8 40.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -106.19 31.03 5.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.49 -66.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 m -78.34 132.64 37.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -77.78 -165.62 26.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.508 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.9 mt -143.84 140.31 29.76 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.9 m-85 -101.7 105.74 16.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.127 0.489 . . . . 0.0 110.241 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -125.4 157.3 37.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.019 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -110.57 136.24 47.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.356 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.096 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.5 135.32 47.83 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 111.453 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.652 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.32 -6.16 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.47 177.0 29.21 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 119.176 -1.488 . . . . 0.0 114.595 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.646 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 144.05 24.12 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.635 ' HE1' HD22 ' A' ' 26' ' ' LEU . 5.0 m-85 -147.86 149.65 32.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.382 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.492 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.37 -14.31 26.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.47 179.638 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 125.28 62.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.041 0.448 . . . . 0.0 111.985 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.2 tmtt? -67.11 -41.01 86.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.492 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.65 66.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.118 0.485 . . . . 0.0 109.906 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -77.93 -35.46 50.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.391 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.98 -19.08 61.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.802 179.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.53 -37.51 21.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.639 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -37.33 86.14 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.826 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.5 tp -66.82 -51.01 60.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.999 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.15 -24.62 59.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.599 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -72.53 -41.41 65.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.519 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.826 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.89 -47.71 84.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.588 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.87 -40.91 94.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.597 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -55.22 -37.14 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.382 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.91 -50.85 65.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.235 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.7 mmtt -62.45 -28.53 69.87 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.5 31.52 3.21 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.519 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.6 m-85 -100.49 157.26 16.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 0.0 110.794 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -86.81 93.98 9.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.758 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.621 ' HA ' HG22 ' A' ' 50' ' ' ILE . 99.2 p -80.29 157.78 26.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.138 0.494 . . . . 0.0 110.918 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.525 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.27 138.51 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.01 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.592 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.1 t -117.41 116.71 52.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.023 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.857 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -113.06 125.14 54.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.0 110.692 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.857 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -86.49 114.16 23.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.195 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.677 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.6 167.02 10.61 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.1 m-20 -54.93 65.16 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.893 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.4 -23.24 3.65 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.116 -1.04 . . . . 0.0 115.035 178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.893 HD23 ' O ' ' A' ' 44' ' ' GLY . 22.9 mt -142.43 163.57 32.47 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.263 1.032 . . . . 0.0 113.035 -178.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.511 ' OH ' HD22 ' A' ' 41' ' ' LEU . 27.8 m-85 -111.95 132.16 54.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.53 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.88 146.55 28.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.126 0.489 . . . . 0.0 111.722 -179.45 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.784 ' CB ' HD23 ' A' ' 26' ' ' LEU . 99.4 t -120.99 102.59 12.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.678 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.525 ' HB3' HG23 ' A' ' 38' ' ' ILE . 36.3 tt0 -111.38 143.76 41.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.274 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.38 123.82 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.525 0.679 . . . . 0.0 111.454 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.53 109.78 0.29 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.04 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -132.85 122.38 24.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.747 0.308 . . . . 0.0 110.259 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.66 175.44 9.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.071 0.462 . . . . 0.0 111.621 -179.248 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.65 -15.38 39.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.124 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.7 t -112.07 126.94 55.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -55.63 -36.28 66.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.178 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -53.04 -30.05 33.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.904 0.383 . . . . 0.0 110.99 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.474 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 5.1 m120 -72.84 -49.37 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.741 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.456 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.81 -40.96 94.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.003 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -60.38 -49.99 75.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.824 0.345 . . . . 0.0 110.83 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.7 m -58.01 -37.77 74.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.783 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.019 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.8 -50.42 50.42 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.782 0.801 . . . . 0.0 110.177 179.297 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.2 -60.81 2.82 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.306 -1.315 . . . . 0.0 111.098 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.7 54.28 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.691 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.46 -38.02 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.75 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.67 -41.71 92.15 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.714 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.3 mttm -62.04 -46.37 89.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.597 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.28 -25.73 63.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.737 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.485 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.23 -23.83 54.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.8 24.51 4.9 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.546 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.68 149.03 52.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.26 72.51 4.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.83 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 144.75 26.52 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.07 0.462 . . . . 0.0 111.69 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.0 pp -133.43 157.67 42.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.756 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 12' ' ' VAL . 84.0 t -109.84 134.68 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.976 0.417 . . . . 0.0 111.029 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.565 HD12 ' HG3' ' A' ' 78' ' ' GLU . 1.7 pt -134.3 142.22 41.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.364 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.502 HD13 ' CE1' ' A' ' 10' ' ' TYR . 14.5 tp -104.41 104.29 14.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.33 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG3' HD12 ' A' ' 76' ' ' ILE . 15.5 mt-10 -133.8 143.73 48.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.909 0.385 . . . . 0.0 111.002 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.834 -179.991 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.825 0.345 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.4 mttm 60.55 175.56 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -100.18 172.94 6.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.25 31.49 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.903 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.05 -47.54 4.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.58 122.16 0.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.032 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 m -139.14 157.76 45.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.661 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.405 ' N ' HD11 ' A' ' 77' ' ' LEU . . . -175.96 -119.08 0.55 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.815 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.703 HD12 ' O ' ' A' ' 78' ' ' GLU . 2.9 mp -144.19 142.94 30.83 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.514 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.2 m-85 -101.92 106.61 17.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.077 0.465 . . . . 0.0 110.05 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.0 mttt -126.45 155.36 42.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.644 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.036 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.27 137.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.395 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -129.96 135.82 48.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.572 0.225 . . . . 0.0 110.996 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.22 -6.35 11.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -179.124 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.91 174.34 28.49 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 119.047 -1.549 . . . . 0.0 114.781 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.715 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.8 143.33 23.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -145.89 149.15 33.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 111.323 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.488 ' HG3' HG23 ' A' ' 19' ' ' VAL . 4.7 ptpp? -61.7 -13.56 23.93 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.345 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.488 HG23 ' HG3' ' A' ' 18' ' ' LYS . 21.3 t -107.43 126.44 63.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.061 0.458 . . . . 0.0 111.94 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 46' ' ' TYR . 5.5 tmtt? -65.87 -42.19 90.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.591 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.54 -33.13 65.8 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.166 0.508 . . . . 0.0 109.895 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -77.16 -36.21 55.37 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.44 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.84 62.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.666 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -35.73 26.88 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 t -64.87 -36.69 85.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.964 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.48 -50.98 48.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.383 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -56.89 -25.25 56.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.067 0.46 . . . . 0.0 110.592 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -41.37 60.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.761 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.964 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.04 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.845 0.355 . . . . 0.0 110.401 179.873 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.978 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.71 -40.35 87.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.308 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -55.37 -36.45 66.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.88 -51.74 54.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.354 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -62.83 -28.49 70.05 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.5 34.25 2.92 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.502 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.77 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.6 m-85 -100.84 156.12 17.55 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.126 0.488 . . . . 0.0 110.92 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.33 89.92 7.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.529 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.657 ' HA ' HG22 ' A' ' 50' ' ' ILE . 1.1 m -80.33 158.68 26.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 110.526 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.501 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -156.87 141.64 8.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.17 -178.372 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 58.8 t -117.81 116.5 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.005 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.836 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -113.51 124.89 53.47 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.813 0.339 . . . . 0.0 110.658 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.836 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -87.36 115.88 25.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.314 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -102.84 166.8 10.26 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.089 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.499 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 46.2 m-20 -54.8 65.4 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.891 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 133.1 -22.18 4.04 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.234 -0.984 . . . . 0.0 115.186 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.891 HD23 ' O ' ' A' ' 44' ' ' GLY . 28.3 mt -141.89 160.15 40.78 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.248 1.024 . . . . 0.0 113.006 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.594 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.0 m-85 -111.23 130.26 55.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.492 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.06 147.92 27.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.175 0.512 . . . . 0.0 111.744 -179.307 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.783 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.5 t -123.08 103.41 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 38' ' ' ILE . 12.5 tt0 -108.97 143.18 38.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.123 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.978 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.9 pp -135.27 123.89 40.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.519 0.676 . . . . 0.0 111.574 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.409 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.73 104.98 0.25 Allowed Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.913 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.01 112.78 14.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.709 0.29 . . . . 0.0 110.339 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.9 171.13 14.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 0.0 111.467 -179.302 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -81.42 -16.44 52.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.007 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.34 131.47 56.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.869 0.366 . . . . 0.0 111.07 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.0 ttpt -58.14 -37.76 75.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.314 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -46.32 -32.54 3.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.094 0.473 . . . . 0.0 110.825 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.461 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 10.4 m120 -73.46 -48.83 30.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.28 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.79 -45.53 89.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.163 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.83 -51.1 71.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 71.5 m -59.19 -35.67 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.884 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.036 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.51 -51.92 31.33 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 121.815 0.817 . . . . 0.0 110.129 179.488 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -59.69 4.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.021 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.06 46.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.387 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt-85 -65.33 -39.9 93.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.88 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.18 -40.97 97.21 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.703 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 40.6 mttm -62.34 -46.85 86.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.664 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.53 -25.44 64.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.794 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.81 -22.49 53.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.368 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.19 23.92 5.61 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.73 149.0 52.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.255 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 31.2 t0 -92.25 74.23 5.37 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.821 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.67 140.51 30.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.088 0.471 . . . . 0.0 111.842 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pt -132.66 149.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.085 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 91.7 t -102.78 135.8 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 0.0 110.969 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 pt -138.87 139.98 39.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 17.5 tp -93.3 105.32 17.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.142 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.703 ' O ' HD12 ' A' ' 9' ' ' LEU . 22.7 mt-10 -95.84 117.95 31.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.182 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.896 179.797 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.822 0.344 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.71 149.8 41.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -133.46 -48.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.3 p -80.19 114.41 19.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.943 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.6 p -174.42 174.47 2.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.919 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.84 -171.29 1.83 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 27.6 m -154.95 88.35 1.18 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 160.0 -155.08 26.17 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.7 mt -144.02 140.28 29.48 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.1 m-85 -101.4 106.45 17.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.312 -0.403 . . . . 0.0 109.987 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttm -126.03 155.7 41.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.007 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.25 142.77 19.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.211 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.301 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 3.6 tt0 -135.15 132.83 38.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 111.166 -179.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.539 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.09 -5.39 10.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.83 174.1 28.09 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 119.209 -1.472 . . . . 0.0 114.562 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.76 143.85 23.9 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.364 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.572 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -147.37 151.45 36.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.374 . . . . 0.0 111.286 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.586 ' HG3' HD22 ' A' ' 45' ' ' LEU . 10.3 mttt -61.14 -15.57 34.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.385 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.4 t -105.8 128.4 60.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 121.032 0.444 . . . . 0.0 112.073 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.4 tmtt? -68.62 -42.59 77.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.481 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.44 -31.29 61.78 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.128 0.489 . . . . 0.0 109.95 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -77.94 -35.2 50.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.464 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.67 -21.19 61.84 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.12 -37.55 23.62 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.441 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -65.15 -36.11 83.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.23 0.538 . . . . 0.0 109.612 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.5 tp -69.07 -48.2 63.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.286 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.401 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.16 -25.93 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.064 0.459 . . . . 0.0 110.426 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.2 t -75.1 -40.63 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.36 -48.25 82.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.921 0.391 . . . . 0.0 110.709 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.92 -38.38 90.73 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.352 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.76 -36.41 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.323 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -50.99 64.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.513 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 9.6 mmpt? -62.2 -28.01 69.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.37 32.39 3.22 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.421 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -99.64 154.76 18.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.01 0.433 . . . . 0.0 110.751 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.39 92.58 7.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.751 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 98.0 p -79.95 156.06 27.41 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.036 0.446 . . . . 0.0 110.967 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.632 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.65 141.47 7.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.772 -178.401 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.597 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.4 t -120.02 119.13 59.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.295 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.842 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -115.27 125.76 53.69 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 110.394 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.842 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.2 tp -87.38 115.06 24.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.307 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.704 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.14 166.63 10.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.892 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.496 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.4 m-20 -55.35 65.96 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.9 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.46 -22.15 3.75 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 120.192 -1.004 . . . . 0.0 115.115 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.4 mt -142.67 161.6 37.64 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.189 0.994 . . . . 0.0 112.704 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.593 ' OH ' HD22 ' A' ' 41' ' ' LEU . 27.7 m-85 -111.1 131.95 54.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.273 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.713 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.7 149.3 27.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 111.79 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.797 ' HB ' HD23 ' A' ' 26' ' ' LEU . 61.8 t -123.0 104.36 14.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.683 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.632 ' HB3' HG23 ' A' ' 38' ' ' ILE . 4.8 tt0 -109.39 142.75 39.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.117 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.04 123.66 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-O 121.551 0.691 . . . . 0.0 111.592 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.91 103.91 0.26 Allowed Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.991 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.441 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -125.31 122.69 37.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.85 172.02 13.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.485 . . . . 0.0 111.567 -179.042 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.41 -16.97 47.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.005 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.12 130.8 56.57 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.827 0.346 . . . . 0.0 111.095 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.6 ttpt -57.95 -38.03 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.359 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -46.46 -31.31 2.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.967 0.413 . . . . 0.0 110.775 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.637 ' O ' HG22 ' A' ' 61' ' ' THR . 6.4 m120 -74.07 -48.69 28.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.379 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.13 -44.63 94.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.155 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -59.07 -52.01 67.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.125 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.9 t -59.49 -34.15 72.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.925 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.007 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -51.88 28.58 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.701 0.763 . . . . 0.0 109.932 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.738 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.11 8.57 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.878 -177.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.43 -35.96 61.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt180 -64.91 -39.48 93.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.682 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.91 -40.75 95.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.584 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 26.3 mttm -61.98 -47.34 85.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.706 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.78 -25.92 64.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.83 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.501 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.98 -21.9 54.0 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.388 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.92 23.91 5.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.484 -179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.573 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.01 148.89 52.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 28.1 t70 -92.37 74.58 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.926 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.13 142.0 29.81 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.104 0.478 . . . . 0.0 111.868 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.3 pt -133.77 151.47 33.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.881 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.521 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.7 t -104.68 134.6 45.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.978 0.418 . . . . 0.0 111.05 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.409 ' C ' HD13 ' A' ' 76' ' ' ILE . 0.0 OUTLIER -135.45 138.04 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.019 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.433 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.2 tp -93.25 107.4 19.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.238 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -89.08 103.88 16.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.004 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.905 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 tp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.953 0.406 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -142.18 -178.02 5.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.872 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 tttt -165.7 37.92 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.74 95.32 5.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.913 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.1 p -100.25 131.23 46.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.9 t -128.84 142.51 50.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.53 149.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.727 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 121.55 167.21 13.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.48 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 39.0 mt -143.49 138.57 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.511 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.3 m-85 -102.0 105.64 16.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.011 0.434 . . . . 0.0 110.109 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -124.99 156.36 38.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.437 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -110.5 138.14 39.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.318 179.865 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 14.0 tt0 -132.22 136.48 47.03 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.888 0.375 . . . . 0.0 111.167 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.66 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.02 -5.39 10.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -179.085 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.38 173.45 28.95 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 118.942 -1.599 . . . . 0.0 114.93 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.785 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.4 142.7 23.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.958 -0.621 . . . . 0.0 109.472 178.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.579 ' CE1' HD22 ' A' ' 26' ' ' LEU . 2.5 m-85 -146.16 149.23 33.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.878 0.37 . . . . 0.0 111.254 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 2.9 ttpt -60.81 -15.31 28.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.419 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.83 130.27 60.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.637 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -69.43 -40.15 77.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.633 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -35.54 66.11 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.286 0.565 . . . . 0.0 109.619 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -73.99 -34.2 64.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.209 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.45 -19.74 61.51 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.761 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -35.49 25.58 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.474 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 t -67.68 -38.92 84.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 0.0 109.724 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.728 HD23 ' HB ' ' A' ' 48' ' ' VAL . 20.4 tp -65.84 -53.29 41.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.379 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.35 -24.52 63.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -70.85 -42.39 70.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.537 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.724 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.89 -46.25 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.518 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.997 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.668 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.43 -37.18 67.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.149 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.94 -49.99 67.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.268 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.83 -29.04 70.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.423 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.14 32.92 2.89 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.539 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.758 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.9 m-85 -101.47 158.36 16.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.053 0.454 . . . . 0.0 110.544 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -87.27 94.86 9.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.634 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.607 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 35.0 p -80.07 157.38 26.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.845 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.59 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.91 137.43 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.752 -178.472 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.7 t -114.22 112.83 41.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.199 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.801 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -109.16 122.98 48.47 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.013 0.435 . . . . 0.0 110.921 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.801 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -87.85 115.0 25.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.709 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -101.44 166.45 10.72 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.499 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 6.5 t0 -55.08 65.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.885 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.01 -23.29 3.73 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 120.207 -0.997 . . . . 0.0 115.071 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.885 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.8 mt -141.21 161.77 37.07 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.277 1.038 . . . . 0.0 112.839 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.603 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.1 m-85 -112.66 134.31 54.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.671 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.38 148.84 28.57 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.156 0.503 . . . . 0.0 111.993 -179.558 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.728 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.9 t -121.89 99.01 6.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.307 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.59 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.2 tt0 -106.42 143.04 35.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.075 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.997 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.75 123.35 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 111.513 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.76 110.12 0.3 Allowed Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 114.763 -1.108 . . . . 0.0 113.053 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -134.66 112.91 11.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.744 0.307 . . . . 0.0 110.52 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.5 174.53 10.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.039 0.447 . . . . 0.0 111.57 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -84.73 -16.24 42.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.19 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.68 128.3 56.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.9 0.381 . . . . 0.0 111.044 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.511 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.0 -36.86 65.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.228 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -53.01 -30.23 34.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.439 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -72.18 -49.21 37.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.803 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.99 -41.2 97.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.002 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.61 -50.99 71.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.971 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.2 m -57.12 -37.64 72.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.811 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -50.1 53.82 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.737 0.78 . . . . 0.0 110.279 179.42 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.733 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.93 -60.64 3.06 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.166 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.74 59.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -63.88 -40.11 95.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.068 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.43 -40.5 95.87 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.69 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 33.3 mttm -62.03 -46.77 87.74 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -69.32 -26.37 64.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.826 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.61 -22.44 54.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.411 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.73 24.19 5.35 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.568 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.74 148.91 52.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 36.4 t70 -92.63 72.71 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.6 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.16 141.87 29.88 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.149 0.499 . . . . 0.0 111.745 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 7.6 pt -133.11 154.75 40.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.925 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.639 HG22 HG13 ' A' ' 12' ' ' VAL . 92.1 t -108.48 135.82 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.953 0.406 . . . . 0.0 110.881 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 pt -137.61 141.27 39.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.562 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.727 HD11 ' HA3' ' A' ' 8' ' ' GLY . 13.4 tp -101.06 102.98 14.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.172 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -105.37 138.45 41.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.846 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -116.05 124.29 50.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.26 84.84 6.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.0 p -76.82 156.93 31.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.19 99.38 1.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.942 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.02 79.38 1.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.4 171.88 19.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.531 ' H ' HD11 ' A' ' 77' ' ' LEU . . . -139.45 -117.69 1.49 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.509 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.605 HD13 ' HZ1' ' A' ' 11' ' ' LYS . 1.4 mt -143.68 138.36 28.86 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.9 m-85 -101.96 105.84 16.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.044 0.449 . . . . 0.0 110.214 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.605 ' HZ1' HD13 ' A' ' 9' ' ' LEU . 2.5 mttm -125.83 153.01 44.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.448 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.027 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.7 136.37 41.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.372 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.358 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.19 135.38 48.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.598 0.237 . . . . 0.0 111.021 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.573 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -6.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.789 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.41 172.09 29.4 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 118.834 -1.65 . . . . 0.0 114.885 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.55 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.92 138.1 19.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.849 -0.675 . . . . 0.0 109.486 178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -148.72 150.76 33.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 111.079 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 32.9 tttt -61.21 -12.65 13.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.068 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -109.13 129.9 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 111.907 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.7 -38.35 67.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.592 179.811 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.8 -34.86 63.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.328 0.585 . . . . 0.0 109.634 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -75.4 -31.87 60.56 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.178 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.36 -18.86 60.62 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.93 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -84.71 -38.18 20.04 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.634 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -68.43 -35.73 78.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 109.588 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.829 HD12 ' ND2' ' A' ' 29' ' ' ASN . 56.7 tp -68.14 -51.99 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.119 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.97 -24.43 62.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.408 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.7 m -71.32 -41.27 70.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.5 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.829 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.64 -46.93 87.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.446 179.568 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.949 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.67 -41.45 90.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.556 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -55.63 -36.83 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.233 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.38 -51.19 63.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.393 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.6 mmpt? -62.73 -28.54 70.03 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.91 32.8 2.98 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.513 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.783 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -101.16 157.62 16.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 110.809 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.41 92.23 8.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.656 ' HA ' HG22 ' A' ' 50' ' ' ILE . 77.3 p -80.35 156.66 26.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.142 0.496 . . . . 0.0 111.033 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.89 141.86 5.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.527 -178.84 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.559 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.0 t -114.65 111.68 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.175 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.801 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -107.29 124.78 50.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.918 0.39 . . . . 0.0 110.511 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.801 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.1 tp -87.11 112.37 21.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.043 0.449 . . . . 0.0 110.914 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -91.67 166.11 12.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.326 178.369 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.477 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.9 OUTLIER -57.43 68.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.815 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.844 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.94 -24.42 3.45 Favored Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.286 -0.959 . . . . 0.0 114.507 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.844 HD23 ' O ' ' A' ' 44' ' ' GLY . 21.2 mt -143.47 170.83 15.06 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 117.799 0.8 . . . . 0.0 112.32 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.536 ' OH ' HD22 ' A' ' 41' ' ' LEU . 24.6 m-85 -115.68 139.58 50.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.303 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -122.23 158.89 28.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.652 HG21 ' HB3' ' A' ' 26' ' ' LEU . 93.0 t -122.99 114.08 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.296 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.572 ' HB3' HG23 ' A' ' 38' ' ' ILE . 23.2 tt0 -112.45 137.52 50.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.797 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.949 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.54 123.97 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.625 0.726 . . . . 0.0 111.488 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.55 102.35 0.21 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.085 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.11 120.99 31.6 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -141.04 174.32 10.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.153 0.501 . . . . 0.0 111.589 -179.065 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.1 m -84.72 -15.76 44.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.001 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -112.42 128.08 56.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.79 0.329 . . . . 0.0 111.098 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -56.6 -35.18 67.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.27 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -51.86 -31.5 28.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.85 0.357 . . . . 0.0 110.98 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 9.9 m120 -71.98 -49.74 34.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.577 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.95 -42.24 93.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.17 -50.93 71.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.819 0.342 . . . . 0.0 110.793 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.8 m -58.54 -37.12 75.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.824 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.027 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.52 -51.27 44.86 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.752 0.787 . . . . 0.0 110.154 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.39 -59.97 3.97 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.091 -177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.31 -36.62 43.51 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -65.69 -39.53 91.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.836 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.0 -41.88 94.97 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.562 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.0 mmmm -61.79 -46.8 87.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.795 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -69.85 -25.55 63.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.747 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.469 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.38 -22.43 54.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.381 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.94 23.39 5.59 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.446 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.39 147.6 52.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 33.8 t70 -91.02 73.36 6.41 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.675 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.6 140.55 30.5 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.105 0.478 . . . . 0.0 111.871 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 pt -132.53 151.15 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.833 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.504 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.4 t -103.95 135.72 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.858 0.361 . . . . 0.0 110.982 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.0 pt -136.36 139.57 45.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.249 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.531 HD11 ' H ' ' A' ' 8' ' ' GLY . 16.6 tp -96.09 106.62 18.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.325 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -93.97 109.04 20.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.873 0.368 . . . . 0.0 111.032 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.959 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.794 0.331 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.88 117.45 14.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.822 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -114.85 -40.69 3.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.961 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 t -130.78 147.42 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.61 76.36 0.38 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 73.1 m -88.94 -176.41 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.957 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 m 62.3 39.26 12.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.84 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -103.88 -131.06 7.09 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.333 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.4 mp -143.95 139.29 29.03 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.52 ' CE1' HD13 ' A' ' 77' ' ' LEU . 41.5 m-85 -101.94 105.72 16.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.035 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.49 152.98 44.24 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.35 137.72 35.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.131 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -132.96 134.47 44.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.698 0.285 . . . . 0.0 111.253 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.581 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.86 -4.79 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.96 174.7 29.01 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 119.135 -1.507 . . . . 0.0 114.766 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.76 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.19 141.78 22.63 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.621 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -147.87 149.8 32.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.025 0.441 . . . . 0.0 111.351 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 8.1 tttt -61.58 -13.74 24.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -106.58 126.18 62.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.794 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.12 -40.57 82.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.469 179.58 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.49 -32.27 64.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.263 0.554 . . . . 0.0 109.9 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -77.54 -34.01 54.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.395 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.506 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.92 -19.54 60.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.849 179.192 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.43 -37.49 21.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.562 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -38.63 88.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.297 0.57 . . . . 0.0 109.63 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 40.5 tp -66.09 -51.48 57.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.188 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.524 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.19 -23.93 57.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.543 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.1 m -73.0 -41.32 64.42 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.677 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.27 -47.16 86.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.604 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.68 -40.61 95.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.578 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -55.14 -37.24 66.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.283 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.76 -49.93 69.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.27 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -62.39 -28.49 69.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.93 31.43 3.36 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.555 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.781 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.1 156.07 17.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.92 0.39 . . . . 0.0 110.799 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.88 93.13 8.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.696 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.0 p -80.28 157.22 26.49 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 121.128 0.489 . . . . 0.0 110.926 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.95 139.66 6.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.705 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.5 t -116.41 115.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.219 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.797 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -110.41 124.29 51.46 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.812 179.815 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.866 HD22 ' OH ' ' A' ' 46' ' ' TYR . 5.0 tp -88.74 114.73 25.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.176 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.68 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.45 166.92 10.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.146 178.236 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.492 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 14.1 t0 -53.72 65.3 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.909 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.19 -23.07 3.71 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 120.218 -0.991 . . . . 0.0 115.295 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.0 mt -141.98 163.51 32.69 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.34 1.07 . . . . 0.0 113.0 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.866 ' OH ' HD22 ' A' ' 41' ' ' LEU . 29.6 m-85 -112.22 134.44 53.76 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.648 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.76 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.55 148.65 28.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.179 0.514 . . . . 0.0 111.84 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.789 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.8 t -120.54 100.41 9.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.393 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.556 ' HB3' HG23 ' A' ' 38' ' ' ILE . 31.5 tt0 -108.97 142.39 39.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.319 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -136.31 122.98 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.538 0.685 . . . . 0.0 111.657 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.16 107.67 0.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.912 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.12 118.59 21.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.651 0.262 . . . . 0.0 110.428 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -138.31 172.79 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 111.48 -179.301 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -84.15 -15.49 46.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.092 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.29 128.81 56.38 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.0 tmtm? -55.65 -35.58 66.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.275 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -53.17 -29.96 34.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.455 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 26.4 m120 -71.56 -49.85 36.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.721 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.515 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.99 -40.87 95.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.061 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.2 -50.96 71.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.741 0.305 . . . . 0.0 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 13.6 m -58.59 -37.46 75.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.58 -51.03 47.03 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.732 0.777 . . . . 0.0 110.085 179.449 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.36 -59.99 3.95 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.093 -177.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.84 -36.05 46.77 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.43 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.98 -38.74 89.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.871 178.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.14 96.28 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.662 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -62.27 -46.25 89.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.722 178.776 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -25.54 63.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.694 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.481 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.45 -23.64 53.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.35 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.9 23.38 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.552 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.549 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.67 148.26 52.44 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 45.6 t0 -91.79 74.03 5.75 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.644 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.07 142.29 30.52 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.066 0.46 . . . . 0.0 111.956 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.4 pt -133.12 151.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.8 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.515 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.5 t -105.42 135.41 43.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.393 . . . . 0.0 111.125 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 30.1 pt -135.51 138.95 47.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.221 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.52 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.1 tp -100.61 104.64 15.98 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.292 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -94.27 113.58 25.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.03 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.859 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.802 0.334 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -67.19 -35.78 80.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.991 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -138.26 70.64 1.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.966 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.439 HG22 ' H ' ' A' ' 5' ' ' SER . 0.2 OUTLIER 60.05 174.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.898 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.439 ' H ' HG22 ' A' ' 4' ' ' THR . 29.4 t -108.8 137.13 47.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.986 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.29 99.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.6 t -92.98 -57.6 2.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.803 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.766 ' O ' HD22 ' A' ' 9' ' ' LEU . . . 83.18 110.86 0.51 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.57 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 8' ' ' GLY . 3.4 mm? -141.68 137.86 32.05 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -100.93 106.77 18.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.195 0.522 . . . . 0.0 110.17 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.406 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 6.7 mttm -125.85 152.97 44.79 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.403 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.032 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.18 140.57 22.81 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.209 179.89 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.421 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 42.2 tt0 -132.92 131.81 41.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.717 0.294 . . . . 0.0 111.281 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.569 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.02 -5.57 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -179.284 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.19 172.28 28.31 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 119.104 -1.522 . . . . 0.0 114.634 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.763 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 141.07 22.09 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 114.884 -0.658 . . . . 0.0 109.254 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.581 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.3 m-85 -146.63 150.28 35.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.913 0.387 . . . . 0.0 111.357 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.37 -13.81 22.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.424 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.45 128.5 60.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.046 0.451 . . . . 0.0 111.989 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 7.2 tmtt? -69.34 -41.13 77.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.487 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.74 -31.06 64.18 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.171 0.51 . . . . 0.0 109.924 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -78.07 -35.1 49.9 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.335 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.56 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.32 -22.99 61.85 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.772 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -38.66 26.85 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.531 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -63.67 -37.73 88.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.228 0.537 . . . . 0.0 109.653 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.2 tp -67.31 -46.03 74.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.198 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -59.39 -26.59 65.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.462 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -41.05 60.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.21 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.1 -48.07 82.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.695 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -63.2 -38.2 90.22 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.348 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -54.85 -36.65 65.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.462 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.01 -51.55 56.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.557 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 7.5 mmtm -62.64 -28.13 69.7 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.78 34.47 2.81 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.461 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.61 155.41 17.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.975 0.416 . . . . 0.0 110.85 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -83.46 94.34 7.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.824 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.574 ' HA ' HG22 ' A' ' 50' ' ' ILE . 80.1 p -79.96 155.2 27.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.971 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.653 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.9 139.95 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.699 -178.503 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.63 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -118.59 116.25 50.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.391 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.798 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -110.62 124.12 51.28 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 110.724 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.798 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.4 tp -88.34 114.83 25.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.228 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.694 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -99.96 166.63 10.96 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 177.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.9 OUTLIER -55.71 66.67 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.904 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 133.82 -22.92 3.8 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.02 -1.086 . . . . 0.0 115.004 178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.904 HD23 ' O ' ' A' ' 44' ' ' GLY . 29.3 mt -141.72 161.78 37.09 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.193 0.996 . . . . 0.0 112.91 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.658 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.7 m-85 -112.78 134.4 54.32 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.622 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.763 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.14 150.59 27.02 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 111.541 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.824 ' HB ' HD23 ' A' ' 26' ' ' LEU . 98.3 t -124.36 102.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.633 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.6 tt0 -106.84 142.86 35.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.047 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.62 123.16 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.472 0.654 . . . . 0.0 111.488 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.522 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.22 105.52 0.23 Allowed Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.894 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.57 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.88 122.38 32.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.659 0.266 . . . . 0.0 110.397 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -140.74 171.62 13.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.203 0.525 . . . . 0.0 111.454 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -17.25 51.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.866 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.0 t -113.78 130.27 56.47 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.865 0.365 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 13.3 ttpt -57.13 -37.47 72.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.398 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.11 -31.16 3.25 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.966 0.412 . . . . 0.0 110.698 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CD1' ' A' ' 53' ' ' PHE . 19.8 m120 -73.28 -49.99 24.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.235 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.556 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.73 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.12 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.24 -51.15 71.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.844 0.355 . . . . 0.0 111.009 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 28.3 m -58.84 -35.21 72.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.918 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.032 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.33 -51.95 26.33 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.747 0.785 . . . . 0.0 110.187 179.435 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.744 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.99 -57.9 9.29 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.231 -1.35 . . . . 0.0 111.013 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.36 -37.39 62.35 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.429 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.4 ttt-85 -64.47 -38.23 90.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.639 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.27 -41.15 94.49 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.624 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.8 mttm -62.17 -46.94 86.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.691 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.29 -25.44 64.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.686 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.468 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.16 -22.54 52.37 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.36 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 23.59 5.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.584 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.563 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.36 148.93 52.72 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.447 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.5 74.74 5.16 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.807 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.47 141.83 29.65 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.062 0.458 . . . . 0.0 111.95 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.587 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -133.27 152.11 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.02 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.556 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.9 t -104.78 136.35 38.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.798 0.333 . . . . 0.0 111.085 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.628 HD12 ' HG2' ' A' ' 78' ' ' GLU . 1.0 OUTLIER -140.3 141.84 32.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.354 -179.893 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.5 tp -90.58 110.76 21.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.196 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.628 ' HG2' HD12 ' A' ' 76' ' ' ILE . 4.6 mm-40 -93.22 143.08 26.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.023 0.44 . . . . 0.0 111.172 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.158 0 CA-C-O 118.108 -0.948 . . . . 0.0 110.832 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.883 0.373 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.9 -52.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 138.87 31.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.887 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.48 176.1 8.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.91 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.5 m -141.14 -49.18 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.958 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.7 m -127.74 162.53 26.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.902 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 m -83.9 163.19 20.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.928 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 61.39 153.65 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.509 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.42 ' H ' HD12 ' A' ' 77' ' ' LEU . 4.2 mp -143.97 140.14 29.48 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.513 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.6 m-85 -101.43 106.62 17.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.037 0.446 . . . . 0.0 109.997 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.49 155.45 38.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.429 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.001 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.78 142.92 18.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.284 179.876 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -133.91 132.74 40.62 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.581 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.07 -5.97 9.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.76 173.79 29.8 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 118.877 -1.63 . . . . 0.0 114.893 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' HG3' ' A' ' 47' ' ' LYS . . . -151.01 135.91 17.36 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.962 -0.619 . . . . 0.0 109.71 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.633 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.0 m-85 -145.01 149.37 35.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.8 0.334 . . . . 0.0 111.08 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 4.7 ttpm? -60.78 -14.13 19.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.937 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -106.76 127.99 61.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.062 0.458 . . . . 0.0 112.107 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -69.64 -42.27 74.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.579 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.11 -32.52 47.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.177 0.513 . . . . 0.0 109.815 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -76.94 -32.58 57.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.282 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.501 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.09 -20.63 60.2 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.891 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -39.13 20.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 110.747 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 t -66.61 -37.13 84.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 0.0 109.659 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.8 tp -66.47 -52.1 49.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.182 179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.654 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.03 -24.45 58.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.441 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.1 t -71.83 -41.74 67.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.556 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.88 -47.55 84.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.571 179.599 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.09 -41.41 92.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.648 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.15 -37.02 66.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.234 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.8 -51.12 64.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.341 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.43 -28.43 69.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.73 31.69 3.11 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.687 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.79 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -101.01 158.0 16.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 94.9 9.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.751 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.654 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 47.5 p -80.29 156.83 26.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.227 0.537 . . . . 0.0 110.982 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.63 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -155.97 137.13 5.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.659 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.501 HG13 ' HB1' ' A' ' 23' ' ' ALA . 39.3 t -113.98 112.67 41.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.785 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -108.09 124.24 49.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.934 0.397 . . . . 0.0 110.614 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.785 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.1 tp -84.99 110.48 18.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.084 0.469 . . . . 0.0 111.211 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.639 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -92.1 166.48 12.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.471 178.675 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.57 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.9 m-20 -57.24 66.08 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.818 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 126.29 -12.02 7.16 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.429 -0.891 . . . . 0.0 114.4 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.818 HD23 ' O ' ' A' ' 44' ' ' GLY . 33.5 mt -144.6 158.18 43.88 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 117.543 0.672 . . . . 0.0 112.561 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.603 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.8 m-85 -111.89 136.31 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.159 177.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.547 ' HG3' ' HB1' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.55 156.53 31.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.12 0.486 . . . . 0.0 111.613 -179.342 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.689 ' HB ' HD23 ' A' ' 26' ' ' LEU . 87.9 t -125.43 113.96 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.48 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.63 ' HB3' HG23 ' A' ' 38' ' ' ILE . 3.3 tt0 -111.93 141.32 45.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.1 123.44 39.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.515 0.674 . . . . 0.0 111.575 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.29 107.59 0.28 Allowed Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.823 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.495 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -129.37 118.37 22.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.688 0.28 . . . . 0.0 110.553 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.03 174.21 10.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.011 0.434 . . . . 0.0 111.551 -179.402 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.4 p -83.57 -17.04 43.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.093 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -112.55 128.34 56.33 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.85 0.357 . . . . 0.0 111.174 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.513 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.53 -34.74 64.96 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.082 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -52.23 -32.0 34.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.045 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.9 m120 -70.89 -49.6 44.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.617 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.46 -40.54 82.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.012 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -61.66 -49.98 74.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.761 0.315 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 1.1 m -59.48 -34.76 72.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.837 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.001 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.01 -51.52 24.95 Favored 'General case' 0 CA--C 1.503 -0.843 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.726 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.25 8.03 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.922 -177.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.67 -37.26 63.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.662 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 61' ' ' THR . 5.5 ttt180 -64.19 -38.73 92.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.777 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.79 -41.05 96.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.67 -46.38 89.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.76 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -69.79 -26.09 64.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.803 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.76 -22.85 53.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.404 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.25 23.59 5.42 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.466 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.566 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.72 148.8 52.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.4 t70 -92.34 73.53 5.29 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.675 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.43 142.79 28.99 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.116 0.484 . . . . 0.0 111.985 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.9 pt -134.69 162.01 39.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.617 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.0 t -112.29 137.03 46.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt -139.97 140.18 36.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.323 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.644 HD11 ' HA3' ' A' ' 8' ' ' GLY . 11.6 tp -92.03 107.42 19.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.306 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -100.82 131.07 46.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.181 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.833 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.561 ' O ' HD12 ' A' ' 1' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.81 94.46 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.929 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -66.19 165.91 12.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.96 163.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.885 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.77 -35.82 6.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.919 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.42 -175.93 4.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -167.51 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.516 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -78.05 -174.05 42.29 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.572 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 93.0 mt -143.84 140.38 29.8 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -100.83 106.63 18.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.074 0.464 . . . . 0.0 110.069 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -126.31 156.77 39.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.52 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.045 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.92 138.99 31.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.316 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.145 179.761 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -131.22 133.75 45.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.717 0.294 . . . . 0.0 111.158 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.518 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.55 -5.64 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.41 175.21 29.08 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.055 -1.545 . . . . 0.0 114.558 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.623 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.62 142.54 23.0 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.995 -0.603 . . . . 0.0 109.426 178.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.611 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.8 m-85 -147.53 150.13 33.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.878 0.37 . . . . 0.0 111.346 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 29.3 pttt -61.72 -13.63 24.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.489 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.27 127.04 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.176 0.512 . . . . 0.0 111.959 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.09 -42.12 80.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.574 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.23 -31.69 63.77 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.148 0.499 . . . . 0.0 110.02 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -78.22 -34.94 49.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.5 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -19.21 61.04 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.881 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.95 -37.66 20.24 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.496 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -37.73 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 59.6 tp -66.26 -51.63 55.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.127 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -57.67 -23.87 53.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.534 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -41.15 64.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.63 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.08 -46.98 86.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.965 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.1 -40.41 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -55.28 -37.11 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.275 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.17 -50.81 66.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.376 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.3 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.07 32.3 3.08 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.537 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.78 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.1 m-85 -100.55 155.8 17.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.949 0.404 . . . . 0.0 110.858 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.44 92.41 8.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.697 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.632 ' HA ' HG22 ' A' ' 50' ' ' ILE . 96.4 p -80.12 157.4 26.65 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.175 0.512 . . . . 0.0 110.894 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.85 142.35 6.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.739 -178.431 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.621 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -121.8 122.41 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.272 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.846 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -114.79 125.24 53.47 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.424 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.846 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -85.2 114.05 22.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.46 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.628 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -101.05 167.18 10.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.089 178.244 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.561 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.2 m-20 -56.02 64.0 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.818 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 127.94 -12.4 6.49 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 120.341 -0.933 . . . . 0.0 114.654 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.818 HD23 ' O ' ' A' ' 44' ' ' GLY . 18.0 mt -144.61 152.86 41.12 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.015 0.907 . . . . 0.0 112.908 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.632 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.8 m-85 -109.34 129.69 55.52 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.407 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.76 147.03 27.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.917 0.389 . . . . 0.0 111.831 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.755 ' CB ' HD23 ' A' ' 26' ' ' LEU . 98.7 t -120.96 105.2 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.737 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 15.3 tt0 -111.86 142.04 44.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.416 -179.389 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.965 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.38 123.78 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-O 121.588 0.708 . . . . 0.0 111.561 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.402 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 81.08 106.32 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.872 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.11 117.45 20.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.666 0.269 . . . . 0.0 110.492 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -137.09 170.11 16.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.138 0.494 . . . . 0.0 111.422 -179.334 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -17.08 53.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.47 131.71 56.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.95 0.405 . . . . 0.0 110.947 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.498 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 5.0 ttpt -57.63 -37.96 74.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.376 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -46.04 -32.98 3.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.049 0.452 . . . . 0.0 110.854 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 13.2 m120 -71.91 -49.2 39.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.411 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.655 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.06 -44.57 87.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.084 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.29 -52.31 66.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.76 0.314 . . . . 0.0 111.209 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.47 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.04 -34.58 72.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.103 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.045 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.3 -51.9 26.86 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.718 0.77 . . . . 0.0 110.135 179.429 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.5 -59.13 5.11 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.029 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.72 -37.21 50.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.276 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.0 -38.25 90.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.784 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.34 -41.91 93.44 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.762 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.9 mttm -62.09 -46.83 87.35 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.638 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.58 -25.29 63.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.811 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.2 -23.3 51.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.336 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.64 23.36 5.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.412 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.18 149.18 52.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.2 t70 -92.98 74.59 4.78 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.662 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.5 143.41 28.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.135 0.493 . . . . 0.0 111.778 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.5 pt -134.69 151.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.837 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.655 HG22 ' HB1' ' A' ' 59' ' ' ALA . 88.1 t -103.61 135.78 39.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt -138.71 140.45 39.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.26 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.516 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.9 tp -94.11 106.05 18.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.16 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -99.08 117.87 34.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.232 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.86 179.93 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.804 0.335 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.68 90.97 2.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -164.93 159.56 18.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.865 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.8 p 50.52 -177.92 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 79.2 p -102.83 -75.12 0.61 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.5 101.48 0.25 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.931 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.92 131.53 19.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.946 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.81 125.03 3.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.537 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 6.7 mt -144.27 141.51 29.87 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.516 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.6 m-85 -101.86 106.79 17.81 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.142 0.496 . . . . 0.0 109.874 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 34.9 mttm -125.05 154.41 41.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.649 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -108.33 137.02 42.06 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.205 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -129.6 135.46 48.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.651 0.263 . . . . 0.0 111.008 -179.391 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.552 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.23 -5.03 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.64 173.52 28.22 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 118.964 -1.589 . . . . 0.0 114.559 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.612 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.87 143.49 23.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.861 -0.669 . . . . 0.0 109.29 178.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.9 m-85 -150.03 148.29 28.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.89 0.376 . . . . 0.0 111.393 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 12.1 pttt -60.8 -13.88 18.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.609 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.08 124.46 61.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.158 0.504 . . . . 0.0 112.116 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -64.93 -44.69 88.68 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.602 179.634 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.65 -31.77 48.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.15 0.5 . . . . 0.0 109.856 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.92 -35.77 50.17 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.593 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.05 -21.51 61.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -37.72 24.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -64.46 -37.18 86.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 109.626 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.977 HD12 ' OD1' ' A' ' 29' ' ' ASN . 26.8 tp -67.41 -50.8 57.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.331 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.579 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.37 -26.39 52.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.083 0.468 . . . . 0.0 110.652 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.34 -41.04 61.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.084 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.977 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.45 -48.92 79.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.962 0.41 . . . . 0.0 110.772 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.948 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.14 -39.32 89.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -54.36 -37.15 64.61 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.16 -50.54 64.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.429 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpp? -62.41 -28.37 69.74 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 33.83 2.82 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.501 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.2 m-85 -102.05 159.89 14.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.989 0.423 . . . . 0.0 110.626 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -87.56 94.06 9.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.602 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.42 157.91 26.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.007 0.432 . . . . 0.0 110.789 -178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.481 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.42 140.12 6.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.007 -178.463 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.59 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 30.1 t -118.99 118.79 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.845 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -114.75 125.9 54.23 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.002 0.429 . . . . 0.0 110.572 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.845 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.1 tp -86.14 114.31 22.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.209 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.66 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -102.14 167.14 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.569 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.6 p-10 -56.18 63.8 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.834 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 128.83 -13.77 6.07 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.367 -0.92 . . . . 0.0 114.778 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.834 HD23 ' O ' ' A' ' 44' ' ' GLY . 12.4 mt -144.49 151.97 39.92 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.072 0.936 . . . . 0.0 113.197 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.639 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.2 m-85 -108.2 128.35 54.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.312 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.612 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -102.72 146.5 28.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.229 0.537 . . . . 0.0 111.872 -178.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.4 t -121.79 103.4 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.621 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.1 tt0 -110.62 143.64 40.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.634 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.948 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.18 123.1 32.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.58 0.705 . . . . 0.0 111.618 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.66 111.78 0.3 Allowed Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.145 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.415 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.99 112.72 11.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.248 . . . . 0.0 110.371 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -129.65 173.77 10.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 0.0 111.522 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 m -83.81 -17.66 40.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.967 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.8 131.94 56.04 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.873 0.368 . . . . 0.0 111.078 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpp -58.06 -39.62 78.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.271 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -46.07 -32.52 2.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.96 0.409 . . . . 0.0 110.761 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 71.0 m-80 -70.98 -49.64 43.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.367 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.711 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.49 -41.02 75.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.04 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -61.45 -49.26 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.87 0.367 . . . . 0.0 110.902 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -60.92 -34.93 75.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.855 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.054 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.88 -53.05 16.55 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.877 0.846 . . . . 0.0 110.047 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.71 -58.83 5.99 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.141 -1.391 . . . . 0.0 110.853 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.86 -37.77 53.43 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.413 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.8 ttt180 -64.86 -39.41 93.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.752 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.03 -41.76 94.96 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.603 179.123 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 29.9 mttt -62.05 -47.14 86.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.695 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -69.14 -25.59 64.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.723 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.68 -22.22 54.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.271 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.85 23.74 5.78 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -129.99 148.58 51.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.392 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.7 t0 -92.06 73.85 5.53 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.926 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.01 140.57 30.93 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.05 0.452 . . . . 0.0 111.913 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 20.7 pt -133.34 152.11 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.922 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.711 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.6 t -103.17 138.18 28.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.898 0.38 . . . . 0.0 111.156 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 pt -141.44 138.78 32.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.351 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.9 tp -95.57 105.8 17.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.172 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -129.04 151.76 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 68.2 m . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.905 179.88 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.453 HD23 ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.809 0.337 . . . . 0.0 111.193 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.453 ' N ' HD23 ' A' ' 1' ' ' LEU . 5.2 mtmp? -103.51 81.64 1.94 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.15 -31.33 43.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -124.51 164.93 18.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.98 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 51.0 m -66.63 -29.64 69.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.961 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.6 t 63.85 126.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.824 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -174.77 -41.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.84 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.44 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -172.43 -167.09 31.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.381 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 85.4 mt -143.84 139.02 29.07 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.5 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -101.28 106.38 17.57 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.064 0.459 . . . . 0.0 109.971 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.12 154.3 41.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.458 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.059 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.58 140.5 24.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.19 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -133.37 135.29 44.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 111.243 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.561 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -108.06 -5.43 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.229 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.33 174.23 28.8 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 118.968 -1.587 . . . . 0.0 114.646 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.765 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.21 141.42 22.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.939 -0.631 . . . . 0.0 109.389 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.638 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.8 m-85 -147.27 149.54 33.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.973 0.416 . . . . 0.0 111.377 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.54 -12.83 16.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.553 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.09 125.93 63.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.078 0.466 . . . . 0.0 112.072 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 10.4 tmtt? -67.02 -42.02 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.414 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.63 -31.32 62.19 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.178 0.514 . . . . 0.0 109.909 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -78.36 -33.96 48.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.473 178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.07 -20.1 60.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.197 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -37.54 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -38.41 87.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.326 0.584 . . . . 0.0 109.512 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.815 HD12 ' ND2' ' A' ' 29' ' ' ASN . 41.8 tp -66.26 -51.49 57.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.21 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -57.93 -24.0 55.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.579 178.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t -72.92 -41.41 64.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.572 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.815 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.23 -47.03 86.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.568 179.834 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.97 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.58 -40.66 95.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.507 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -55.11 -37.26 66.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.312 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.28 67.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.171 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.36 -28.49 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.656 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.04 31.5 3.31 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.416 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.18 156.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.984 0.421 . . . . 0.0 110.777 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -85.68 93.33 8.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.728 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 81.7 p -80.43 157.6 26.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.23 0.538 . . . . 0.0 110.873 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.34 140.1 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.754 -178.543 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.15 116.31 51.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.272 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.805 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -110.27 123.59 50.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.844 0.354 . . . . 0.0 110.697 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.805 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -88.02 115.37 25.45 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.148 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.711 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -101.49 166.69 10.59 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 8.9 t0 -55.26 65.68 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.907 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.31 -23.62 3.64 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.202 -0.999 . . . . 0.0 115.156 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.907 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.5 mt -141.01 161.15 38.53 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 118.215 1.008 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.611 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.9 m-85 -112.23 133.76 54.16 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.723 178.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.765 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.79 148.78 28.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.056 0.455 . . . . 0.0 111.733 -179.567 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.796 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.5 t -121.31 100.9 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.653 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -107.51 142.1 37.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.162 -179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.97 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.0 123.59 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-O 121.653 0.74 . . . . 0.0 111.658 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.92 105.58 0.26 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.701 -1.136 . . . . 0.0 113.002 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.61 112.68 14.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.754 0.311 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.28 171.69 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.066 0.46 . . . . 0.0 111.62 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -17.45 50.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.8 t -114.44 132.67 56.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.018 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.5 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.8 ttpp -58.24 -37.68 75.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.336 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -46.47 -32.13 3.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.109 0.48 . . . . 0.0 110.825 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.447 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 30.5 m120 -72.57 -49.58 31.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.35 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.688 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.46 -44.74 85.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.157 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -59.71 -50.35 74.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.826 0.346 . . . . 0.0 110.987 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.44 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.0 m -60.17 -35.23 74.88 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.806 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.059 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -52.01 27.54 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-O 121.811 0.815 . . . . 0.0 109.989 179.493 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -58.72 6.38 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.179 -1.373 . . . . 0.0 111.066 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.27 -36.42 52.7 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.385 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt180 -65.82 -39.17 90.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.702 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.99 -41.16 97.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.574 178.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 36.8 mttm -61.88 -46.07 91.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.751 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -70.16 -25.48 63.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.806 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.482 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.07 -23.11 52.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.239 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.15 24.0 5.29 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.407 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.31 147.82 52.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 13.0 t70 -92.31 74.44 5.32 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.689 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.89 142.71 29.51 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.105 0.479 . . . . 0.0 111.908 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -133.94 153.04 35.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.855 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.688 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.0 t -102.83 136.06 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.955 0.407 . . . . 0.0 111.123 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt -136.27 135.05 49.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.106 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.475 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.0 tp -96.18 105.65 17.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.251 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -99.31 125.51 44.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.029 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.882 179.953 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.0 tp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.936 0.398 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -144.51 31.43 1.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.934 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -138.64 -47.2 0.5 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.958 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.6 p -94.6 44.49 1.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.81 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -44.93 82.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.906 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.2 m -144.78 102.41 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.864 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -126.74 79.27 1.86 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.031 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.09 -136.93 5.47 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.394 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 0.7 OUTLIER -144.05 139.2 28.82 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.8 m-85 -101.33 106.66 17.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 110.097 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -124.84 154.06 41.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.462 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.047 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.57 139.73 27.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.33 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -131.79 133.09 44.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.733 0.301 . . . . 0.0 111.058 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.58 -5.46 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -179.048 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.57 175.45 28.51 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 119.123 -1.513 . . . . 0.0 114.553 178.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.741 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.81 145.36 24.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.946 -0.627 . . . . 0.0 109.342 178.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.577 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.4 m-85 -149.11 153.1 37.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.123 0.487 . . . . 0.0 111.531 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HG2' HD23 ' A' ' 45' ' ' LEU . 20.4 mttp -61.42 -16.78 50.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.255 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -106.93 129.25 60.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 112.182 -179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.6 OUTLIER -70.57 -39.89 73.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.316 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.03 -32.84 66.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 0.0 109.9 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -76.58 -34.66 58.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.254 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.65 -18.47 61.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.826 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -37.7 21.01 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.513 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.6 t -66.02 -38.04 87.43 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 57.3 tp -65.6 -51.34 60.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.058 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.635 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.04 -23.91 56.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.493 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.0 t -72.8 -41.25 65.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.545 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.55 -47.97 83.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.541 179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.55 -41.22 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.605 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.91 -37.43 66.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.36 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.06 69.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.359 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 12.6 mmtt -62.29 -28.28 69.61 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.72 31.33 3.21 Favored Glycine 0 N--CA 1.442 -0.918 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.608 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.764 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -101.6 158.81 15.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.915 0.388 . . . . 0.0 110.853 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.92 93.94 9.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.816 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.635 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 57.6 p -80.4 157.94 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.997 0.427 . . . . 0.0 110.813 -178.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.531 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -158.48 140.7 5.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.92 -178.569 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.37 117.46 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.07 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.869 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -115.14 126.83 55.09 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.996 0.427 . . . . 0.0 110.647 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.869 ' N ' HD12 ' A' ' 40' ' ' LEU . 4.9 tp -88.0 113.81 24.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.694 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.23 166.9 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.1 t0 -53.97 64.91 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.909 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 135.19 -23.13 3.51 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 120.129 -1.034 . . . . 0.0 115.254 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 44' ' ' GLY . 18.2 mt -143.28 163.44 32.96 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.366 1.083 . . . . 0.0 112.852 -178.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.818 ' OH ' HD22 ' A' ' 41' ' ' LEU . 30.5 m-85 -110.36 132.28 54.32 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.331 177.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.741 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.04 147.66 29.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.172 0.51 . . . . 0.0 111.955 -179.159 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.737 ' HB ' HD23 ' A' ' 26' ' ' LEU . 94.9 t -120.29 104.19 15.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.531 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.3 tt0 -109.6 141.26 42.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.359 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.3 123.7 39.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.602 0.715 . . . . 0.0 111.597 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.48 108.97 0.29 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.925 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.71 112.87 13.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.728 0.299 . . . . 0.0 110.377 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.16 170.38 14.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 111.432 -179.285 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 t -79.64 -18.27 51.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.027 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -115.33 137.87 51.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.92 0.39 . . . . 0.0 111.109 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -61.49 -38.9 88.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.634 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -45.83 -31.77 2.25 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.962 0.411 . . . . 0.0 111.016 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 27.0 m120 -73.14 -49.06 30.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.694 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.12 -43.3 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.991 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -60.91 -49.35 77.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.811 0.338 . . . . 0.0 110.938 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.1 m -61.17 -33.86 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.047 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.52 -52.49 18.02 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 121.739 0.78 . . . . 0.0 109.934 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.763 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.98 -57.86 9.96 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.787 -178.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.17 -37.72 55.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.41 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.1 ttt85 -65.21 -37.94 88.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.821 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.52 -42.83 91.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.611 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.3 mmmm -61.34 -46.56 89.74 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.854 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -70.24 -25.41 63.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.738 178.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.442 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.77 -22.96 53.0 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.56 23.43 5.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.483 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.584 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.87 148.12 52.6 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 32.4 t70 -91.89 75.04 5.65 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.565 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.63 141.69 29.61 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.846 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.584 HD12 HG23 ' A' ' 76' ' ' ILE . 1.2 pp -133.27 153.04 36.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.911 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.694 HG22 ' HB1' ' A' ' 59' ' ' ALA . 76.9 t -104.86 137.18 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.031 0.443 . . . . 0.0 111.14 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.584 HG23 HD12 ' A' ' 74' ' ' ILE . 6.7 pt -136.96 136.4 47.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.208 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.439 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.1 tp -102.62 106.2 16.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -103.22 135.49 44.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.051 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.887 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.857 0.361 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.83 -166.63 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.78 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.89 -77.11 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.892 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -87.87 161.37 17.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.829 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -82.75 111.5 18.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.958 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.1 m 63.38 141.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 m -102.02 41.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.792 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.537 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -152.35 153.56 24.97 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.483 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' H ' HD12 ' A' ' 77' ' ' LEU . 9.7 mt -144.04 140.5 29.56 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.742 0.306 . . . . 0.0 110.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.8 m-85 -102.32 106.48 17.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.114 0.483 . . . . 0.0 109.968 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 42.6 mttt -124.51 154.78 40.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.467 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.68 145.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.309 179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tm0? -137.78 134.01 34.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -178.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.564 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.2 -5.41 10.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.77 169.47 27.31 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 119.256 -1.45 . . . . 0.0 114.623 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.74 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.93 140.75 21.85 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.508 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.7 m-85 -151.38 150.08 30.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -60.81 -13.81 17.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.478 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.05 128.9 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-O 120.897 0.38 . . . . 0.0 111.794 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -71.8 -40.97 68.83 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.682 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.92 -29.51 20.46 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.232 0.539 . . . . 0.0 109.725 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -81.82 -31.88 31.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.726 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.76 -23.08 58.48 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.03 179.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -83.02 -40.36 20.04 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.624 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -37.29 86.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.211 0.529 . . . . 0.0 109.775 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.919 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.2 tp -68.21 -47.53 67.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.279 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.58 -25.85 63.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.046 0.45 . . . . 0.0 110.503 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -74.75 -41.08 60.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.045 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.919 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.05 -48.71 80.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.813 0.34 . . . . 0.0 110.627 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.88 -38.18 89.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.382 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -54.63 -36.88 64.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.398 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.99 -50.17 64.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.434 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.32 -28.0 69.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.696 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.27 32.25 3.53 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.188 -0.914 . . . . 0.0 112.383 179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.796 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -99.18 154.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.973 0.416 . . . . 0.0 110.724 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -81.54 92.51 6.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.004 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.596 ' HA ' HG22 ' A' ' 50' ' ' ILE . 93.5 p -79.69 155.25 28.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.123 0.487 . . . . 0.0 110.927 -178.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.635 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.39 140.92 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.822 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 42.3 t -118.59 118.17 57.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.118 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -115.65 126.76 54.57 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-O 121.065 0.46 . . . . 0.0 110.561 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.816 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.5 tp -87.8 113.02 23.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.064 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.686 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -96.6 166.91 11.44 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.471 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -55.92 67.15 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.896 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 136.11 -25.37 3.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 120.165 -1.017 . . . . 0.0 114.942 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.896 HD23 ' O ' ' A' ' 44' ' ' GLY . 16.7 mt -143.18 167.09 22.94 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.081 0.94 . . . . 0.0 112.953 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.621 ' OH ' HD22 ' A' ' 41' ' ' LEU . 30.6 m-85 -112.83 134.69 54.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.623 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -109.22 151.18 26.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.161 0.505 . . . . 0.0 111.784 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.727 ' HB ' HD23 ' A' ' 26' ' ' LEU . 86.5 t -123.9 102.19 10.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.565 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.635 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -106.7 141.98 37.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.89 -179.267 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 123.1 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.61 0.719 . . . . 0.0 111.246 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.45 104.63 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.849 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.535 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -125.73 124.02 40.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.646 0.26 . . . . 0.0 110.666 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.04 174.36 10.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.036 0.446 . . . . 0.0 111.404 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -83.49 -16.7 44.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.74 130.59 56.41 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.977 0.418 . . . . 0.0 111.172 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.493 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.69 -34.66 67.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.164 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -52.34 -32.57 38.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 0.0 111.07 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.683 ' O ' HG22 ' A' ' 61' ' ' THR . 2.6 m120 -70.26 -48.45 56.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.693 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.614 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.24 -39.98 92.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.841 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -60.16 -51.78 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.683 HG22 ' O ' ' A' ' 58' ' ' ASN . 15.4 t -58.91 -34.75 72.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 0.0 110.855 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.4 -50.96 33.15 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.741 0.781 . . . . 0.0 110.049 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.0 -58.19 7.8 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.044 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.6 -35.46 65.84 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.65 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -63.96 -40.9 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 179.083 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.35 -40.07 95.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.451 178.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.0 mmmm -61.71 -47.24 86.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.719 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -26.34 65.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.809 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.51 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.67 -21.93 54.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.587 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.66 23.21 5.74 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.385 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.609 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.58 148.97 52.44 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 8.3 t0 -92.08 74.72 5.51 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.807 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.8 143.16 27.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.911 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -136.46 162.95 34.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.7 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.614 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.7 t -111.58 136.77 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.959 0.409 . . . . 0.0 111.013 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 9.8 tt -140.78 140.01 33.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.12 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.537 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.2 tp -89.54 117.88 28.76 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.139 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -88.44 101.04 13.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 61.4 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.884 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.848 0.356 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -107.72 97.28 7.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.25 -39.8 5.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.895 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -149.38 175.59 11.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -176.51 -42.74 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.9 m 59.62 83.2 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.81 22.48 3.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.13 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.75 -158.83 17.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.574 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.7 mp -144.22 142.47 30.52 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.503 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -100.9 107.28 18.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.146 0.498 . . . . 0.0 110.018 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -127.2 155.74 42.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.596 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.1 137.58 38.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.2 179.829 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -130.36 133.3 46.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.336 . . . . 0.0 111.024 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.546 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -104.8 -4.79 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.67 174.73 28.76 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 119.05 -1.548 . . . . 0.0 114.674 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.759 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.34 140.37 21.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.548 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -144.75 148.84 34.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.834 0.35 . . . . 0.0 111.401 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 25.7 tttt -61.06 -14.42 23.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.448 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.2 t -107.17 128.94 61.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.092 0.472 . . . . 0.0 111.92 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.4 OUTLIER -68.72 -42.74 77.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.579 179.655 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.87 -32.04 60.33 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 109.852 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -77.45 -35.16 54.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.315 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.31 -18.97 61.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.771 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.81 -37.62 20.55 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.488 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.4 t -65.03 -37.0 86.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.98 HD12 ' OD1' ' A' ' 29' ' ' ASN . 33.7 tp -68.49 -50.41 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.198 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.45 -26.07 52.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -40.49 60.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.146 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.98 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.65 -48.71 80.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.919 0.39 . . . . 0.0 110.665 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.72 -39.06 90.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.359 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -54.67 -37.13 65.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.336 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.11 -49.59 68.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.425 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.0 mmtt -62.28 -28.3 69.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.29 32.88 3.09 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.473 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -101.82 159.08 15.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.983 0.421 . . . . 0.0 110.682 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -87.04 94.69 9.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.879 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.585 ' HA ' HG22 ' A' ' 50' ' ' ILE . 87.4 p -80.38 157.04 26.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.09 0.472 . . . . 0.0 110.818 -178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.91 141.69 6.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.771 -178.472 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.615 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 20.6 t -119.69 117.93 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.494 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -109.33 122.6 47.72 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.874 0.369 . . . . 0.0 110.77 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -84.13 111.62 19.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.159 0.504 . . . . 0.0 111.091 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.633 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -100.11 167.26 10.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.368 178.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.582 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -55.91 64.62 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.827 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 124.12 -10.16 8.33 Favored Glycine 0 CA--C 1.522 0.525 0 C-N-CA 120.499 -0.857 . . . . 0.0 114.467 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.827 HD23 ' O ' ' A' ' 44' ' ' GLY . 27.8 mt -144.15 150.79 38.61 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 117.94 0.87 . . . . 0.0 112.813 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.694 ' OH ' HD22 ' A' ' 41' ' ' LEU . 24.1 m-85 -109.6 131.65 54.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.563 178.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.759 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.08 147.79 27.51 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.17 0.509 . . . . 0.0 112.022 -179.473 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 93.7 t -120.67 101.64 11.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.362 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 11.3 tt0 -109.02 142.25 39.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.595 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.14 123.38 39.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.539 0.685 . . . . 0.0 111.5 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.24 105.64 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 114.827 -1.078 . . . . 0.0 113.054 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.57 116.36 19.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.778 0.323 . . . . 0.0 110.232 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.58 173.53 11.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.027 0.441 . . . . 0.0 111.604 -179.158 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.42 -17.85 40.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.07 131.92 56.21 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.888 0.375 . . . . 0.0 111.078 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -58.66 -38.96 79.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.397 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -44.98 -33.89 2.21 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.963 0.411 . . . . 0.0 110.782 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 8.7 m120 -72.47 -48.78 38.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.331 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.574 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.69 -45.23 85.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.001 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.33 -50.65 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.864 0.364 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 5.2 m -58.58 -36.18 73.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.61 34.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 121.709 0.766 . . . . 0.0 110.065 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.93 -59.54 4.59 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.026 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.96 -37.89 47.27 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.567 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.4 ttt180 -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.983 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.96 -42.93 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.776 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.46 -47.13 87.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.658 178.83 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -25.86 64.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.74 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.476 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.94 53.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.315 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.33 23.18 5.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.515 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.572 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.21 148.94 52.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.462 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.0 t70 -92.93 74.44 4.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.07 142.06 28.98 Favored 'General case' 0 CA--C 1.524 -0.029 0 CA-C-O 121.108 0.48 . . . . 0.0 111.751 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -133.4 149.91 31.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.03 179.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.574 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.6 t -102.72 136.27 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.895 0.379 . . . . 0.0 111.078 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 pt -140.49 142.78 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.25 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 19.5 tp -95.48 107.54 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.279 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -98.18 124.96 43.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.218 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.916 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 33.9 mt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.2 120.96 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.935 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -126.06 -44.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.987 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -64.52 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.952 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -150.66 142.1 23.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.9 p -107.84 -39.57 5.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.8 t 63.64 126.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.774 ' O ' HD22 ' A' ' 9' ' ' LEU . . . -79.14 -172.46 42.49 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.52 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 8' ' ' GLY . 3.1 mm? -143.31 141.02 30.84 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 45.7 m-85 -101.62 106.35 17.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.058 0.456 . . . . 0.0 109.98 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 10.2 mttt -125.68 153.18 44.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.689 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.88 136.65 39.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.164 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -129.69 134.78 47.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.808 0.337 . . . . 0.0 111.163 -179.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.521 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.07 -6.16 10.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -178.754 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.44 173.06 29.61 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 118.792 -1.671 . . . . 0.0 114.944 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.17 137.52 18.52 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.467 178.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.9 m-85 -146.2 149.35 33.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.784 0.326 . . . . 0.0 111.058 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 21.5 tttt -59.69 -14.66 15.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.828 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.51 130.29 60.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.096 0.474 . . . . 0.0 112.049 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -72.23 -40.6 67.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.623 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.62 -34.18 57.62 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.303 0.573 . . . . 0.0 109.791 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -75.32 -32.67 61.02 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.212 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.39 -20.2 60.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.034 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -83.34 -38.48 22.0 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.681 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.86 -38.23 85.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.315 0.579 . . . . 0.0 109.646 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 48.6 tp -65.31 -51.1 62.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.149 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.539 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.98 -24.85 63.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.574 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.377 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.3 -46.93 87.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.426 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.36 -42.65 87.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.622 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -55.34 -37.28 67.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.311 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -52.54 -51.54 59.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.296 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 3.5 mmpt? -63.2 -28.97 70.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.21 33.28 2.79 Favored Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.528 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.95 160.14 14.75 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.925 0.393 . . . . 0.0 110.81 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -88.96 94.68 10.03 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.773 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -80.6 157.55 25.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.146 0.498 . . . . 0.0 110.861 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.7 140.16 5.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.724 -178.699 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 23' ' ' ALA . 21.4 t -115.11 112.51 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.282 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -104.73 121.65 44.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.998 0.428 . . . . 0.0 110.714 179.595 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.816 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.8 tp -84.46 110.3 18.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.312 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.65 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -94.0 166.32 12.21 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.46 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.584 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 24.1 t0 -57.24 64.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -178.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.882 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 126.45 -9.24 7.35 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.468 -0.872 . . . . 0.0 114.371 178.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.882 HD23 ' O ' ' A' ' 44' ' ' GLY . 42.7 mt -143.89 152.59 41.34 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 117.586 0.693 . . . . 0.0 112.4 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.652 ' OH ' HD22 ' A' ' 41' ' ' LEU . 23.8 m-85 -110.85 134.82 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.444 177.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.27 155.51 29.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.967 0.413 . . . . 0.0 111.455 -179.558 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' A' ' 26' ' ' LEU . 59.3 t -125.21 109.91 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.959 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.48 ' HB3' HG23 ' A' ' 38' ' ' ILE . 32.9 tt0 -110.09 142.05 42.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.034 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.82 122.76 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 121.601 0.715 . . . . 0.0 111.525 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.0 105.0 0.32 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.826 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -128.41 113.31 15.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.696 0.284 . . . . 0.0 110.429 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -132.15 173.4 11.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.23 0.538 . . . . 0.0 111.389 -179.274 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -16.27 46.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.106 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.93 129.44 56.47 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.892 0.377 . . . . 0.0 111.094 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.4 OUTLIER -56.1 -35.36 66.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.25 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.9 -32.2 31.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.451 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 11.3 m120 -70.34 -49.83 45.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.558 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.3 -41.25 88.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.011 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -60.22 -50.86 72.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.7 0.285 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.8 m -59.0 -36.9 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.83 -51.43 40.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 121.834 0.826 . . . . 0.0 110.17 179.375 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.61 -60.3 3.53 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.211 -1.358 . . . . 0.0 111.124 -177.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -36.97 40.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.462 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -65.41 -39.3 91.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.835 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.7 -41.92 95.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.662 179.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.4 mttt -61.59 -46.65 88.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.698 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -69.74 -25.52 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.691 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.96 -22.72 52.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.402 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 24.14 5.42 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.545 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.52 148.29 52.3 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.02 72.48 5.55 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.852 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.81 141.39 30.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.1 0.476 . . . . 0.0 111.722 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 6.9 pt -133.61 152.22 34.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.007 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.602 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.9 t -103.39 136.2 37.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.867 0.365 . . . . 0.0 111.039 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.1 tt -138.76 140.8 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.34 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.519 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.1 tp -99.38 104.01 15.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.128 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -93.16 115.15 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.023 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.852 179.794 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.835 0.35 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -150.69 114.56 5.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.39 155.18 37.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.9 p -70.19 -174.96 0.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.845 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.7 79.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.9 m -118.83 95.97 5.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.883 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.1 p -116.3 -37.93 3.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.542 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -98.51 170.86 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.447 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 15.2 mt -143.99 140.95 29.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -101.83 106.72 17.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.459 ' HD3' ' NE2' ' A' ' 49' ' ' GLN . 12.8 mttt -124.8 155.65 39.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.47 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.992 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.59 141.61 23.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.435 179.627 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.441 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 17.7 tt0 -134.47 134.43 41.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.729 0.3 . . . . 0.0 111.319 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.651 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.71 -5.11 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.235 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.14 172.08 27.99 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 119.071 -1.538 . . . . 0.0 114.82 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.814 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.29 145.51 25.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 178.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.493 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.1 m-85 -151.63 151.62 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.004 0.431 . . . . 0.0 111.33 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 1.1 tttt -60.45 -15.46 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.422 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.7 t -106.38 128.39 60.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.001 0.429 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.24 -40.46 74.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.3 -33.08 62.96 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.267 0.556 . . . . 0.0 109.739 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -75.97 -33.83 59.77 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.264 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.91 -22.75 61.44 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.775 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.71 -37.21 31.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.596 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -38.58 89.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.215 0.531 . . . . 0.0 109.758 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.929 HD12 ' OD1' ' A' ' 29' ' ' ASN . 15.2 tp -66.93 -47.28 72.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.23 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.782 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -60.27 -25.61 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 110.578 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -40.52 57.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.018 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.929 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -60.25 -48.4 81.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.339 . . . . 0.0 110.626 -179.924 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.5 -38.76 91.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.255 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -54.96 -36.58 65.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.278 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.62 73.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.229 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.3 -28.17 69.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 31.14 3.55 Favored Glycine 0 N--CA 1.442 -0.936 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.497 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -100.37 156.92 16.98 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.794 0.331 . . . . 0.0 110.711 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.83 95.41 9.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.999 179.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.782 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 19.1 p -80.24 155.85 27.14 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.201 0.524 . . . . 0.0 111.044 -178.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.657 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -155.47 139.88 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.548 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.8 t -117.87 116.3 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.543 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.904 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -117.98 128.7 55.04 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.864 0.364 . . . . 0.0 110.458 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.904 ' N ' HD12 ' A' ' 40' ' ' LEU . 6.8 tp -91.36 117.06 29.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.954 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.697 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -107.7 143.85 35.62 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.38 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.458 ' HB2' ' CE ' ' A' ' 42' ' ' LYS . 1.4 m-20 38.73 -85.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.806 0.336 . . . . 0.0 110.692 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.638 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -141.25 14.7 2.77 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.06 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.697 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 17.3 mt -118.47 158.28 25.63 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.016 0.436 . . . . 0.0 111.116 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.789 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 22.7 m-85 -116.13 135.5 53.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.178 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.32 149.4 28.7 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.107 0.48 . . . . 0.0 111.268 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.641 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.7 t -122.04 100.45 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.609 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.657 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.4 tt0 -104.75 142.01 35.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.78 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.03 122.76 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.438 0.637 . . . . 0.0 111.425 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.475 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 82.01 107.38 0.4 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.78 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.533 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -127.7 121.06 29.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.258 . . . . 0.0 110.584 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -141.19 172.31 12.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.111 0.481 . . . . 0.0 111.424 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -83.99 -16.22 44.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.221 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 m -111.63 127.49 55.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.84 0.352 . . . . 0.0 111.198 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -54.82 -36.49 65.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -52.97 -30.03 32.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.423 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -71.81 -49.61 37.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.639 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.471 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.41 -40.87 95.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.937 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.24 -50.7 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 m -58.38 -36.57 73.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.674 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.992 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -69.24 -50.04 50.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.746 0.784 . . . . 0.0 110.065 179.355 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.7 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.76 -59.22 4.9 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.284 -1.325 . . . . 0.0 111.135 -177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.49 -36.1 63.8 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.792 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -40.82 97.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.961 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.81 -39.22 93.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.495 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.8 mttm -62.66 -46.66 87.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.569 178.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -26.23 64.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.734 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.483 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.59 -22.26 54.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.508 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.7 23.15 5.75 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.592 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.33 148.56 52.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 10.0 t70 -91.93 74.63 5.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.752 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.86 142.0 29.2 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.151 0.5 . . . . 0.0 112.117 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -134.07 160.98 41.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.748 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.482 HG22 HG13 ' A' ' 12' ' ' VAL . 98.5 t -113.1 137.58 45.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.904 0.383 . . . . 0.0 111.072 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.2 pt -139.55 140.11 37.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.454 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.542 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.8 tp -92.41 105.75 17.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -96.77 121.74 38.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.046 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.928 179.91 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -79.27 128.25 33.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.41 -171.21 1.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -70.22 -55.24 9.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.993 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 t 62.87 121.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.2 m -146.89 121.96 10.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.543 ' O ' HD11 ' A' ' 77' ' ' LEU . 0.3 OUTLIER -152.78 154.38 35.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.921 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.774 ' O ' HD22 ' A' ' 9' ' ' LEU . . . 111.88 -157.91 14.66 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.353 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 8' ' ' GLY . 3.0 mm? -143.24 138.6 29.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.64 ' CE1' HD13 ' A' ' 77' ' ' LEU . 41.9 m-85 -102.35 106.08 16.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.119 0.485 . . . . 0.0 110.172 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.422 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 12.4 mttm -125.14 153.46 42.98 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.474 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.97 139.99 26.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.342 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -134.33 134.35 41.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.617 0.246 . . . . 0.0 111.236 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.4 -4.8 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.128 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.58 175.87 29.0 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 118.993 -1.575 . . . . 0.0 114.757 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.813 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.78 148.47 27.9 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.588 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.4 m-85 -152.76 151.88 31.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.959 0.409 . . . . 0.0 111.441 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.65 -14.82 22.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.421 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.46 127.76 64.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.143 0.497 . . . . 0.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.86 -38.21 73.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.344 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -33.57 67.94 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.172 0.511 . . . . 0.0 109.658 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -75.62 -33.5 60.51 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.115 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.74 -18.54 60.97 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.798 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.55 -36.96 21.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.478 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -38.05 84.19 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.81 HD12 ' ND2' ' A' ' 29' ' ' ASN . 49.0 tp -66.22 -51.6 56.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.105 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.67 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.23 -24.37 59.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.306 178.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -41.04 67.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.587 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.81 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.53 -46.95 87.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.45 179.66 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.45 -41.18 93.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.45 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -55.05 -36.86 66.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.55 -51.44 62.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.303 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.0 mmpt? -62.6 -28.61 70.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.55 32.83 2.83 Favored Glycine 0 N--CA 1.443 -0.854 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.585 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.9 m-85 -101.2 158.51 15.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.698 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -87.38 94.93 9.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.923 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.67 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 21.7 p -80.56 157.01 26.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.15 0.5 . . . . 0.0 110.972 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.552 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.59 141.08 6.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.643 -178.789 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.88 116.56 52.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.51 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.912 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -116.94 129.38 56.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 179.68 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.912 ' N ' HD12 ' A' ' 40' ' ' LEU . 9.7 tp -91.35 117.64 29.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.191 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.681 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -111.11 151.93 27.54 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.42 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.553 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 32.12 -85.72 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.74 0.305 . . . . 0.0 110.731 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.681 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -139.76 10.34 3.14 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 121.442 -0.408 . . . . 0.0 112.334 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.674 ' O ' HD12 ' A' ' 41' ' ' LEU . 10.3 mt -117.42 161.66 19.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.061 0.43 . . . . 0.0 111.612 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.865 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 25.6 m-85 -116.22 137.33 52.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.173 178.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.83 146.81 31.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.065 0.459 . . . . 0.0 111.248 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.716 ' HB ' HD23 ' A' ' 26' ' ' LEU . 72.8 t -117.74 100.33 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.58 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.552 ' HB3' HG23 ' A' ' 38' ' ' ILE . 37.6 tt0 -104.89 140.37 38.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.136 -179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.34 123.07 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.562 0.696 . . . . 0.0 111.57 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.71 106.99 0.25 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 114.739 -1.119 . . . . 0.0 112.879 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.422 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -130.13 115.58 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 110.484 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -134.27 173.5 11.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.227 0.537 . . . . 0.0 111.495 -179.252 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.52 -16.35 45.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.157 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.02 129.2 56.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.829 0.347 . . . . 0.0 111.081 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.519 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.9 OUTLIER -56.25 -35.15 67.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.221 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -52.44 -30.8 31.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.449 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 27.9 m120 -71.86 -49.92 33.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.71 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.513 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.86 -41.24 91.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.28 -51.01 71.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.998 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.69 -34.81 73.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.94 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.32 -51.6 28.96 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.804 0.811 . . . . 0.0 109.892 179.425 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.762 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.49 -58.91 5.63 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.932 -178.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.32 -37.28 55.44 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.476 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -64.69 -38.93 92.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.823 178.834 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.13 96.3 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.553 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 48.0 mttm -61.85 -46.8 87.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.654 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.66 -25.68 64.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.818 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.483 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.79 -22.41 53.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.278 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.34 24.18 5.47 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.421 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.74 147.98 52.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 23.0 t70 -91.58 73.42 5.93 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.607 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -83.99 140.92 31.58 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.16 0.505 . . . . 0.0 111.859 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.646 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -132.07 150.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.88 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.513 HG22 ' HB1' ' A' ' 59' ' ' ALA . 89.6 t -104.12 134.83 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.848 0.356 . . . . 0.0 110.966 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.72 HD12 ' HG3' ' A' ' 78' ' ' GLU . 1.3 pt -134.28 136.9 52.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.127 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.64 HD13 ' CE1' ' A' ' 10' ' ' TYR . 17.8 tp -97.61 105.8 18.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.202 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.72 ' HG3' HD12 ' A' ' 76' ' ' ILE . 85.8 mt-10 -95.28 120.35 35.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.011 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.251 1.178 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.843 179.86 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.664 HD13 ' N ' ' A' ' 1' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.792 0.33 . . . . 0.0 111.374 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -170.34 106.41 0.31 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.904 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -133.52 -45.89 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.993 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.5 t -135.55 -46.53 0.68 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.918 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t -59.7 121.46 11.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.867 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -156.1 151.73 27.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.5 121.73 45.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.571 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 133.04 165.0 11.04 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.582 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.3 mt -143.92 140.44 29.71 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.517 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.2 m-85 -101.76 106.53 17.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.177 0.513 . . . . 0.0 110.127 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -126.15 153.24 44.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.344 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.018 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.21 138.44 31.63 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.145 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.439 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 16.1 tt0 -132.12 133.38 44.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.717 0.294 . . . . 0.0 111.127 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.635 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -107.34 -4.97 10.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.275 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.56 171.04 28.24 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 119.152 -1.499 . . . . 0.0 115.034 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.873 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 144.46 24.89 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 178.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.454 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -152.84 151.05 29.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.534 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -59.46 -15.33 16.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.598 179.593 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.63 128.35 61.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.95 0.405 . . . . 0.0 111.8 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.47 -39.1 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.45 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -32.69 63.56 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -76.34 -32.89 58.92 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.183 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.648 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.99 -23.6 61.44 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.722 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -37.46 30.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.717 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -65.48 -38.9 91.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.237 0.541 . . . . 0.0 109.877 179.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.932 HD12 ' OD1' ' A' ' 29' ' ' ASN . 14.7 tp -66.99 -45.91 76.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.232 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -61.13 -26.25 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.058 0.456 . . . . 0.0 110.537 179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.69 -40.87 61.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.041 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.932 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.6 -48.43 81.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.758 0.313 . . . . 0.0 110.642 179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.957 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.25 -38.26 88.57 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.282 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -54.9 -37.02 65.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.232 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.72 67.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.423 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.35 -28.28 69.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.625 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.42 33.37 3.16 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.438 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -100.75 156.28 17.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.94 0.4 . . . . 0.0 110.779 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.02 94.51 8.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.84 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.557 ' HA ' HG22 ' A' ' 50' ' ' ILE . 91.9 p -80.23 155.51 27.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.206 0.527 . . . . 0.0 111.126 -178.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.645 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.62 137.7 7.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.717 -178.617 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.648 HG13 ' HB1' ' A' ' 23' ' ' ALA . 22.0 t -117.6 115.69 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.38 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.753 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -119.83 134.86 55.09 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.849 HD22 ' CZ ' ' A' ' 46' ' ' TYR . 15.2 tp -94.77 118.07 31.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.95 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.699 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -110.03 152.9 25.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.366 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.544 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER 30.38 -86.91 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.215 0.322 . . . . 0.0 110.815 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.699 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -137.38 9.96 3.78 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 121.182 -0.532 . . . . 0.0 112.253 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.76 ' O ' HD12 ' A' ' 41' ' ' LEU . 10.6 mt -117.34 160.52 20.99 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.042 0.449 . . . . 0.0 111.584 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.849 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 21.5 m-85 -115.3 136.55 52.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.076 178.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.873 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.82 149.62 28.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.186 0.517 . . . . 0.0 111.412 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.573 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.6 t -122.54 99.37 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.445 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.645 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -104.66 142.22 35.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.984 -179.282 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.957 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 122.59 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 111.396 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.559 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.96 104.81 0.26 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 114.818 -1.083 . . . . 0.0 112.867 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.644 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -127.24 125.4 40.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -144.25 173.67 11.56 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.135 0.493 . . . . 0.0 111.574 -179.337 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 97.1 p -83.47 -16.59 45.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.062 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.42 129.74 56.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.886 0.374 . . . . 0.0 111.078 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.9 -34.85 68.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.237 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -51.52 -31.9 25.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.883 0.373 . . . . 0.0 111.134 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.464 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.0 m120 -71.68 -49.57 38.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.697 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.502 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.45 -43.32 96.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.44 -51.44 69.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.931 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 70.6 m -57.88 -37.15 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.878 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.018 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.77 -51.12 44.45 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.714 0.768 . . . . 0.0 110.304 179.555 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.74 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.02 -59.67 4.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.099 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.73 -36.6 57.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.507 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.26 -39.6 94.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.765 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.64 -40.46 95.49 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.533 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.7 mttm -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.588 178.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -68.58 -25.94 65.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.846 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.502 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.97 -22.26 53.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.5 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 23.13 5.88 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.418 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.564 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.34 148.96 52.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.379 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.475 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.6 t70 -92.63 74.67 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.958 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.37 140.67 30.58 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.105 0.478 . . . . 0.0 111.907 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 11.3 pt -132.89 150.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.969 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.502 HG22 ' HB1' ' A' ' 59' ' ' ALA . 99.3 t -103.91 136.83 35.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.077 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.536 HD12 ' CD ' ' A' ' 78' ' ' GLU . 2.7 pt -137.34 139.2 44.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.347 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.571 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.1 tp -103.75 105.1 15.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.362 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.536 ' CD ' HD12 ' A' ' 76' ' ' ILE . 48.5 mt-10 -125.46 147.79 49.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.13 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.203 -0.904 . . . . 0.0 110.816 179.919 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.419 HD23 ' OG1' ' A' ' 4' ' ' THR . 4.2 mp . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.915 0.388 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.41 -47.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -105.53 92.09 4.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.419 ' OG1' HD23 ' A' ' 1' ' ' LEU . 22.5 m -130.19 -46.12 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.6 m -170.54 128.12 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.01 34.68 2.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.907 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.82 -30.65 11.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.757 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -176.02 162.1 30.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.506 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 0.5 OUTLIER -143.9 139.29 29.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.4 m-85 -101.5 106.62 17.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.088 0.47 . . . . 0.0 109.896 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -125.54 152.46 45.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.451 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.037 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.59 136.65 38.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.283 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -128.06 135.48 49.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.598 0.237 . . . . 0.0 111.111 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.668 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.32 -6.14 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.828 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.61 173.08 29.82 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 118.795 -1.669 . . . . 0.0 115.374 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.34 142.68 23.38 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 114.62 -0.79 . . . . 0.0 108.949 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.33 150.38 28.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.949 0.405 . . . . 0.0 111.331 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 10.9 pttp -59.89 -15.38 21.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.617 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -107.88 127.27 64.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.005 0.431 . . . . 0.0 111.826 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.33 -38.26 68.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.658 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.29 -34.92 61.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.249 0.547 . . . . 0.0 109.591 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -73.98 -32.37 63.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.124 178.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.443 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.78 -19.99 60.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.978 179.172 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -82.12 -38.72 24.35 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.733 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -36.75 79.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.245 0.545 . . . . 0.0 109.799 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.84 HD12 ' ND2' ' A' ' 29' ' ' ASN . 51.0 tp -65.52 -51.95 56.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.472 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.11 -28.48 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.123 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -41.7 85.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.617 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.84 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.8 -47.92 83.78 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.692 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.76 -42.1 88.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.673 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.9 -37.17 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.395 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.23 -51.11 63.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.344 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.521 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpt? -62.61 -28.76 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.3 32.78 2.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.488 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.723 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -102.11 159.82 15.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.959 0.409 . . . . 0.0 110.716 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -88.33 94.88 9.98 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.907 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.586 ' HA ' HG22 ' A' ' 50' ' ' ILE . 78.2 p -80.69 156.62 26.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.155 0.503 . . . . 0.0 110.91 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.92 135.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -112.06 112.04 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.111 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.781 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -114.67 132.21 56.47 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.857 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.781 ' N ' HD12 ' A' ' 40' ' ' LEU . 10.8 tp -90.67 111.88 23.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.3 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.707 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.5 OUTLIER -104.67 152.46 22.46 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.429 ' HB3' ' NZ ' ' A' ' 42' ' ' LYS . 2.3 t70 32.99 -83.18 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.844 0.354 . . . . 0.0 111.256 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.646 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -144.91 17.33 1.97 Allowed Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.709 ' O ' HD12 ' A' ' 41' ' ' LEU . 8.8 mt -126.21 166.44 17.08 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.123 0.487 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.649 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 26.2 m-85 -117.4 138.56 51.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.758 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -119.08 156.52 29.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.986 0.422 . . . . 0.0 110.806 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.668 HG12 HD11 ' A' ' 14' ' ' ILE . 58.7 t -124.62 109.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.357 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' HG23 ' A' ' 38' ' ' ILE . 35.3 tt0 -107.41 140.99 39.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.473 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.71 122.95 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.536 0.684 . . . . 0.0 111.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.58 104.96 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.871 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.95 112.65 14.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -130.39 171.05 13.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.078 0.466 . . . . 0.0 111.472 -179.188 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 t -80.83 -17.75 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.032 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -113.16 130.92 56.05 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.81 0.338 . . . . 0.0 111.053 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.9 ttpt -57.08 -38.85 73.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.72 -31.38 2.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.099 0.476 . . . . 0.0 110.776 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 33.4 m120 -72.21 -49.76 32.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.319 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.726 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.87 -43.32 81.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.118 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.29 -49.61 76.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.861 0.362 . . . . 0.0 110.843 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.7 m -60.18 -35.43 75.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.037 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.29 -52.87 19.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.874 0.845 . . . . 0.0 110.147 179.371 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.761 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.48 -58.92 5.57 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.899 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.63 -37.76 51.68 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt-85 -65.29 -37.97 88.8 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.798 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.42 -42.5 92.42 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.783 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 18.6 mttm -61.54 -46.51 89.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.696 178.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.78 -25.34 63.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.658 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.478 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.39 -23.17 50.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.283 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.05 23.97 5.33 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.524 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.529 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.04 148.76 52.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 12.8 t70 -92.24 73.48 5.38 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.1 140.42 30.24 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.079 0.466 . . . . 0.0 111.681 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.51 HD12 HG23 ' A' ' 76' ' ' ILE . 1.0 OUTLIER -132.87 152.35 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.003 179.211 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.726 HG22 ' HB1' ' A' ' 59' ' ' ALA . 86.7 t -101.65 138.04 27.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.943 0.401 . . . . 0.0 111.051 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.51 HG23 HD12 ' A' ' 74' ' ' ILE . 7.0 pt -141.3 138.14 33.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.252 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.757 HD11 ' HA3' ' A' ' 8' ' ' GLY . 11.7 tp -91.25 107.27 19.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.288 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -100.4 124.86 46.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.053 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.9 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 mt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.78 0.324 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.39 -31.58 7.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.993 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -148.2 142.99 26.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 58.0 m 60.33 102.8 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.82 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.09 78.67 7.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.983 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.69 127.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.817 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.8 p -149.72 123.8 9.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.403 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 121.29 151.31 8.52 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.409 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.2 mt -143.96 139.67 29.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -101.39 106.29 17.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.016 0.436 . . . . 0.0 110.209 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.33 154.37 43.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.607 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.31 140.03 25.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.277 179.821 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.657 ' HB3' HD11 ' A' ' 74' ' ' ILE . 3.9 tt0 -132.09 136.95 47.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.743 0.306 . . . . 0.0 111.145 -179.13 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.51 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.97 -6.28 11.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -179.037 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.78 172.71 29.52 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.892 -1.623 . . . . 0.0 115.021 178.861 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.97 134.34 16.2 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 114.856 -0.672 . . . . 0.0 109.474 178.406 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.634 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -143.34 149.0 37.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.38 -12.0 12.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.894 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.55 129.06 63.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.951 0.405 . . . . 0.0 112.033 -179.558 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.4 ttpt -70.31 -41.53 73.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.684 179.794 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.38 -33.71 54.82 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.217 0.532 . . . . 0.0 109.803 179.2 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -76.48 -32.29 58.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.321 178.459 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.68 -21.18 60.34 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.98 179.416 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -83.68 -38.03 22.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.2 t -67.07 -37.21 83.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.187 0.518 . . . . 0.0 109.648 179.061 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 44.3 tp -66.98 -51.89 49.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.3 -24.3 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -72.44 -41.36 66.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.635 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.27 -46.93 87.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.532 179.696 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.54 -40.66 95.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -36.91 66.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.38 179.73 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.7 -51.42 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.31 179.457 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.63 -28.52 69.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.692 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.28 32.71 2.92 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.65 179.069 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.8 m-85 -100.71 156.48 17.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.56 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -85.3 94.54 8.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.655 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 29.5 p -80.03 155.54 27.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.919 -178.664 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.35 135.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.741 -178.587 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 23' ' ' ALA . 40.2 t -112.91 111.01 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.127 179.918 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.818 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -105.21 121.6 44.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.013 0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.818 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.7 tp -84.6 110.51 18.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.979 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.632 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -93.85 166.4 12.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.248 178.464 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.569 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 11.0 t0 -57.04 66.51 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.798 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 124.38 -9.85 8.23 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.486 -0.864 . . . . 0.0 114.45 178.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 44' ' ' GLY . 44.6 mt -144.66 154.12 42.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 117.707 0.753 . . . . 0.0 112.581 -179.395 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.642 ' OH ' HD22 ' A' ' 41' ' ' LEU . 24.0 m-85 -111.08 134.89 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.444 178.065 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -117.14 155.39 29.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 111.409 -179.547 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.75 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.2 t -126.46 108.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.358 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 38' ' ' ILE . 3.1 tt0 -109.77 143.26 39.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.696 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.42 123.54 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.521 0.677 . . . . 0.0 111.746 179.799 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.472 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.77 104.18 0.26 Allowed Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.968 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.459 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -126.73 120.58 29.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.676 0.274 . . . . 0.0 110.32 179.363 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -139.17 171.36 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.033 0.444 . . . . 0.0 111.581 -179.114 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -80.97 -17.34 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.962 179.53 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.01 131.58 56.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.025 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.2 ttpt -57.8 -37.63 74.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -46.18 -32.77 3.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.041 0.448 . . . . 0.0 110.988 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.454 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 45.9 m-80 -71.83 -49.61 36.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.736 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.6 -44.18 85.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.206 179.581 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.79 -51.92 67.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.757 0.313 . . . . 0.0 111.192 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.59 -34.11 72.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.059 -179.871 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.92 -53.2 15.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.83 0.824 . . . . 0.0 110.138 179.561 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.752 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.75 -58.56 6.79 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.911 -178.041 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.37 -37.67 56.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.396 179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.0 ttt180 -64.64 -37.65 88.29 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.788 178.888 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.62 -42.29 91.71 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.721 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 20.7 mttt -61.53 -46.61 89.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.682 178.71 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -69.88 -25.32 63.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.481 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.459 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.6 -23.25 49.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.217 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.38 24.25 5.13 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.53 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.87 148.84 52.57 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.302 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 22.5 t0 -92.63 74.28 5.06 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.727 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 142.1 28.1 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.183 0.516 . . . . 0.0 111.705 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.768 ' O ' HD12 ' A' ' 74' ' ' ILE . 2.2 pp -134.72 153.57 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.801 178.899 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.736 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.6 t -101.12 136.53 32.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.946 0.403 . . . . 0.0 111.041 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.2 pt -136.42 135.75 49.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.39 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.437 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.8 tp -98.79 104.61 16.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.199 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -119.47 138.57 53.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.999 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.82 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.79 0.329 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -159.76 127.83 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.8 mtmm -163.08 97.87 0.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.824 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.514 HG23 ' O ' ' A' ' 4' ' ' THR . 8.3 t -159.01 105.34 1.75 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.871 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 m -97.31 87.73 4.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.46 31.41 5.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.09 163.94 13.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.992 179.899 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.654 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 165.8 157.98 10.44 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.967 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 1.2 mt -143.75 138.33 28.73 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.31 106.85 18.08 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.105 0.479 . . . . 0.0 110.085 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.7 mttp -126.78 154.18 44.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.446 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.025 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -109.28 135.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.141 179.701 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -127.68 138.14 52.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.542 0.21 . . . . 0.0 111.07 -179.356 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.612 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -108.16 -4.59 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.923 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.38 176.27 30.24 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 118.609 -1.758 . . . . 0.0 115.352 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.62 143.94 24.07 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.596 -0.802 . . . . 0.0 108.999 178.024 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.483 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.1 m-85 -152.95 144.07 23.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.954 0.407 . . . . 0.0 111.635 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.55 -17.29 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.187 179.761 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.28 127.57 62.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.284 0.564 . . . . 0.0 112.175 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tmtt? -70.16 -41.78 73.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.634 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.03 -35.51 47.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.301 0.572 . . . . 0.0 109.763 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -74.47 -32.8 62.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.221 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.72 -27.36 63.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.81 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.83 -37.32 55.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -34.31 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.196 0.522 . . . . 0.0 109.877 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.99 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.0 tp -69.73 -51.98 29.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.465 179.566 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.408 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.95 -26.41 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.2 m -73.95 -40.81 62.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.104 179.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.99 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.3 -49.4 77.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.745 -179.926 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.936 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.85 -39.42 89.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.294 179.542 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.83 -36.21 64.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.2 179.59 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -50.13 68.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.268 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 2.1 mmtt -62.54 -28.61 69.97 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.731 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.54 33.56 2.87 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.609 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.7 m-85 -101.46 157.6 16.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 110.736 179.564 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.69 93.3 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.879 179.254 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.6 p -80.5 157.15 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.151 0.501 . . . . 0.0 111.136 -178.707 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.526 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.98 140.07 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.429 -178.768 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.498 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -118.5 116.61 51.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.565 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.775 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -107.22 121.59 44.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.616 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.775 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.5 tp -77.26 108.64 10.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.269 0.557 . . . . 0.0 111.046 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.575 ' CE ' HD12 ' A' ' 45' ' ' LEU . 3.3 tmmm? -91.1 165.48 13.49 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.86 179.49 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 50.4 t0 -61.24 66.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.808 0.337 . . . . 0.0 111.719 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.936 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 118.58 -11.15 12.45 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.808 -0.71 . . . . 0.0 113.535 179.333 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.936 HD23 ' O ' ' A' ' 44' ' ' GLY . 5.9 mt -138.7 148.32 43.82 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 117.464 0.632 . . . . 0.0 112.251 -179.234 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.772 ' CE1' HD13 ' A' ' 41' ' ' LEU . 21.3 m-85 -109.25 127.27 54.13 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.615 178.313 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.47 151.82 25.05 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.128 0.489 . . . . 0.0 111.496 -179.713 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.634 HG21 ' HB3' ' A' ' 26' ' ' LEU . 52.7 t -125.77 106.73 16.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.084 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.526 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.6 tt0 -105.66 141.08 37.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.936 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.6 123.59 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.524 0.678 . . . . 0.0 111.392 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.59 108.73 0.29 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 114.798 -1.092 . . . . 0.0 113.14 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.456 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.56 124.11 26.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.508 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -143.2 175.76 9.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 111.599 -179.18 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -84.52 -18.81 34.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.02 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.38 129.52 55.99 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.888 0.375 . . . . 0.0 111.084 -179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtm? -56.49 -36.87 69.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.52 -179.781 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -50.69 -31.69 17.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.865 0.364 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 14.7 m120 -71.34 -49.38 43.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.699 179.925 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG13 ' A' ' 75' ' ' VAL . . . -60.62 -43.21 97.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.128 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.66 -52.05 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 110.835 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.9 m -55.45 -39.87 70.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.025 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -66.86 -50.37 62.72 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.737 0.779 . . . . 0.0 110.59 179.608 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.696 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -52.03 -62.04 1.88 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.382 -177.739 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.87 -35.2 61.29 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.939 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.1 ttt180 -63.67 -40.59 97.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.003 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.06 -40.97 95.51 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.741 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.9 mttm -61.67 -47.56 84.8 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.653 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -68.7 -25.87 65.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.79 178.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.35 -22.13 52.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.584 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.35 23.78 5.62 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.586 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.546 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.0 149.89 52.41 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.294 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.504 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 9.2 t0 -92.3 73.75 5.33 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.961 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.3 140.09 29.89 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.042 0.448 . . . . 0.0 111.887 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.1 pt -133.7 153.14 36.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.891 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.665 HG22 HG13 ' A' ' 12' ' ' VAL . 89.3 t -105.77 138.6 30.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.005 0.431 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 pt -142.22 142.36 27.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.405 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.654 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.7 tp -91.69 107.83 19.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.211 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.01 103.7 16.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.018 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.32 -0.847 . . . . 0.0 111.034 179.794 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.8 ttmt -171.25 -42.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.11 117.35 2.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 t -155.65 141.02 17.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m -163.0 134.52 5.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.761 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -106.05 115.25 29.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.976 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.09 -175.93 3.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.964 -179.957 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.56 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 108.26 163.93 21.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.559 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 26.2 mt -143.85 140.61 29.9 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.774 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.53 106.93 18.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.1 0.476 . . . . 0.0 110.017 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.1 mttt -127.98 155.32 44.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.45 137.82 38.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.364 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.452 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 60.9 tt0 -128.91 135.29 48.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.906 -179.436 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.599 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.79 -4.69 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -178.777 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.26 175.99 29.81 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.616 -1.754 . . . . 0.0 115.273 178.466 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.533 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.67 144.37 24.32 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.247 178.06 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.528 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -152.69 144.21 23.4 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.988 0.423 . . . . 0.0 111.51 -179.526 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.91 -16.27 1.76 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.202 179.819 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -108.45 127.88 64.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 112.236 -179.289 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.3 ttpt -69.83 -42.03 74.16 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.636 179.588 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -35.28 49.53 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.183 0.515 . . . . 0.0 109.758 179.108 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -74.6 -33.08 62.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.303 178.398 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.511 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -70.76 -25.76 63.05 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.749 179.091 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.16 -36.63 47.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -66.48 -35.4 80.19 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.993 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.8 tp -69.02 -52.57 27.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.442 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.07 -25.96 47.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.482 . . . . 0.0 110.647 179.043 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.8 t -74.66 -40.4 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.993 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.64 -48.9 79.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.62 -179.883 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.945 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.16 -39.63 90.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.157 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.56 -36.1 63.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.279 179.588 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.67 -51.6 62.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.66 -28.72 70.11 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.746 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.03 34.82 2.47 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.662 178.964 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -101.83 159.07 15.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.911 0.386 . . . . 0.0 110.723 179.391 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.44 94.43 9.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.12 179.382 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.562 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.55 156.83 26.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.223 0.535 . . . . 0.0 110.965 -178.681 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.561 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -156.2 137.87 5.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.511 HG13 ' HB1' ' A' ' 23' ' ' ALA . 19.6 t -116.22 114.43 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.567 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.8 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -107.1 122.25 46.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.58 179.665 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.8 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.7 tp -77.6 108.28 10.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.305 0.574 . . . . 0.0 111.175 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' CE ' HD12 ' A' ' 45' ' ' LEU . 3.7 tmmm? -90.76 165.48 13.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.913 179.444 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 35.6 t70 -61.27 66.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 111.661 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.936 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 119.64 -12.17 11.05 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.678 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.936 HD23 ' O ' ' A' ' 44' ' ' GLY . 4.9 mt -139.19 150.48 45.62 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 117.479 0.64 . . . . 0.0 112.452 -179.29 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.761 ' CE1' HD13 ' A' ' 41' ' ' LEU . 22.0 m-85 -109.75 128.06 55.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.518 178.282 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.496 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -107.79 151.7 25.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.183 0.516 . . . . 0.0 111.512 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.675 ' HB ' HD23 ' A' ' 26' ' ' LEU . 51.0 t -125.45 105.53 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.068 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.561 ' HB3' HG23 ' A' ' 38' ' ' ILE . 7.5 tt0 -104.3 141.54 36.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.945 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.57 123.57 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.46 0.647 . . . . 0.0 111.593 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.528 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.37 107.38 0.23 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.208 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.487 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -131.96 123.46 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.529 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.34 175.16 9.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.176 0.512 . . . . 0.0 111.649 -179.224 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 p -83.43 -18.75 37.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.009 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.49 129.32 56.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.955 0.407 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -55.49 -35.9 66.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.258 -179.876 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -50.21 -32.62 16.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.453 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 9.5 m120 -70.79 -50.15 38.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.551 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.66 -44.72 93.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.169 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -57.57 -52.84 63.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 0.0 110.884 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 24.9 m -55.67 -38.94 70.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.908 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.02 -51.08 59.3 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.788 0.804 . . . . 0.0 110.475 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.661 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.24 -61.56 2.22 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.279 -177.573 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.81 -36.91 49.57 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -63.63 -39.54 94.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.859 179.141 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.94 -41.85 90.79 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.732 179.032 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.5 mttm -61.14 -48.27 82.39 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.626 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.18 -25.99 65.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.803 178.559 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.493 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.77 -21.04 52.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.497 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.34 24.21 5.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.518 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB2' ' HB1' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.35 149.81 52.4 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.162 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.5 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 46.3 t0 -92.8 73.61 4.92 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.965 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.85 139.28 31.41 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.06 0.457 . . . . 0.0 111.747 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.7 pt -132.82 149.76 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.161 179.089 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.551 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.4 t -101.88 137.22 30.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.93 0.395 . . . . 0.0 111.017 179.82 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.3 pt -138.49 139.12 41.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.237 -179.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.56 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.3 tp -96.83 107.97 20.56 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.244 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -135.07 132.97 38.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.893 -179.999 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.792 0.329 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.67 -179.36 6.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.872 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.04 -48.35 0.45 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.9 t -101.65 127.8 48.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.841 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.17 -44.1 2.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.917 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.7 t -89.85 123.07 33.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.84 128.18 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.492 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -64.18 143.87 47.92 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.493 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 18.0 mt -143.86 138.96 29.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.512 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -100.93 106.77 18.13 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.117 0.484 . . . . 0.0 110.058 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.98 154.78 42.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.591 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.99 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.48 138.84 33.32 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.151 179.706 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.435 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 6.7 tt0 -131.35 135.43 47.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.684 0.278 . . . . 0.0 110.985 -179.211 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.693 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -5.41 10.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.853 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.85 175.68 30.05 Favored Glycine 0 C--N 1.338 0.664 0 C-N-CA 118.772 -1.68 . . . . 0.0 115.285 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.61 142.95 23.41 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.046 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -153.06 144.17 23.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.015 0.436 . . . . 0.0 111.625 -179.348 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.4 OUTLIER -53.93 -16.16 1.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.02 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.03 126.7 64.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.344 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 3.9 ttpt -69.39 -41.28 76.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.381 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.87 -34.28 53.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.249 0.547 . . . . 0.0 109.647 179.064 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.74 -33.09 62.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.161 178.355 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.9 -18.64 60.88 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.016 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.92 -38.62 20.83 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.67 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -67.52 -37.54 82.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.284 0.564 . . . . 0.0 109.524 178.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.846 HD12 ' ND2' ' A' ' 29' ' ' ASN . 54.3 tp -65.67 -51.91 55.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.992 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.501 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -59.06 -24.21 62.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.611 179.238 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.41 -40.55 70.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.28 179.45 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.846 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.76 -48.44 81.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.659 179.787 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.937 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.53 -42.81 88.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.519 -179.871 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -55.12 -37.23 66.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.151 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.13 -51.25 64.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.361 179.395 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 14.6 mmtt -62.64 -28.86 70.21 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.67 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.22 33.56 2.51 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.752 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -104.22 164.22 11.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.594 179.379 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.55 92.52 8.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.939 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.681 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -81.22 127.37 32.61 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.288 0.566 . . . . 0.0 111.178 -178.794 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -124.61 139.04 52.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.671 -179.217 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.9 t -116.04 113.11 42.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.196 179.934 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.79 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -106.4 122.23 45.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.809 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.79 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.7 tp -77.37 108.03 10.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.144 0.497 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 44' ' ' GLY . 4.3 tmmm? -90.59 165.39 13.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.821 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.486 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.4 t0 -60.62 66.28 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.774 -179.726 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.935 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 121.6 -16.75 8.98 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.667 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.935 HD23 ' O ' ' A' ' 44' ' ' GLY . 4.2 mt -136.66 152.81 50.82 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 117.495 0.648 . . . . 0.0 112.425 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.739 ' CE1' HD13 ' A' ' 41' ' ' LEU . 22.8 m-85 -109.75 129.28 55.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.544 178.201 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -109.76 151.78 26.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.42 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.693 HG12 HD11 ' A' ' 14' ' ' ILE . 67.5 t -124.03 105.41 15.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.011 179.792 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 8.4 tt0 -104.63 141.44 36.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.516 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.937 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.48 123.1 36.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.431 0.634 . . . . 0.0 111.668 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.39 108.13 0.35 Allowed Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.945 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.468 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -130.48 122.27 27.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.519 0.199 . . . . 0.0 110.468 179.586 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.47 172.64 12.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.47 . . . . 0.0 111.518 -179.295 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 t -82.87 -16.81 46.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.059 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.83 129.9 56.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.512 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.0 tmtt? -56.77 -35.31 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.264 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -50.32 -32.97 18.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 110.928 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.455 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 14.5 m120 -70.71 -49.59 45.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.725 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.46 -42.93 93.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.117 179.801 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -58.84 -52.15 66.97 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.106 -179.832 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -58.18 -35.79 72.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.921 -179.93 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.99 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.51 35.28 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 121.757 0.789 . . . . 0.0 110.188 179.561 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.72 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.62 -60.62 3.1 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.064 -177.829 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.85 51.55 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.663 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.6 ttt180 -63.1 -38.16 90.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.814 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.68 -41.99 91.78 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.723 179.085 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 43.4 mttm -61.39 -47.59 85.13 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.621 178.727 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -68.91 -25.44 64.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.69 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.43 -21.96 52.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.392 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.78 24.2 5.63 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.375 -179.34 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.542 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.78 149.09 52.58 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -179.214 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.6 t70 -92.25 71.89 5.33 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.695 179.827 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.25 141.39 30.14 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-O 121.09 0.471 . . . . 0.0 111.731 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.08 152.62 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.572 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.0 t -104.73 135.19 43.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.875 0.369 . . . . 0.0 110.953 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt -137.7 140.57 41.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.36 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.492 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.3 tp -94.74 106.07 18.04 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.19 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -94.17 111.0 22.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 -179.615 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.901 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.8 mt . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.873 0.368 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -106.72 106.06 16.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.844 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -100.39 31.93 3.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 78.0 p -75.26 168.69 19.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.2 p -116.6 38.41 3.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.6 t -108.19 135.97 48.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.882 179.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.6 m -76.31 169.52 18.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.981 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.636 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 161.07 171.2 26.74 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.636 179.986 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 81.7 mt -143.86 141.25 30.23 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.523 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.8 m-85 -101.25 107.28 18.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.109 0.48 . . . . 0.0 109.974 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.3 mttm -126.08 155.37 41.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.4 179.802 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.999 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.07 137.49 40.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.212 179.811 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tt0 -128.44 133.4 48.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.675 0.274 . . . . 0.0 111.409 -179.357 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.935 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -98.6 -5.61 9.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.13 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 151.31 -176.49 29.75 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 119.037 -1.554 . . . . 0.0 114.813 178.458 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.534 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -152.35 144.41 23.81 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.929 -0.636 . . . . 0.0 109.428 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.501 ' HE2' HD22 ' A' ' 26' ' ' LEU . 16.7 m-85 -153.22 141.89 20.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.914 0.388 . . . . 0.0 111.532 -179.595 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.22 -15.57 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.892 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.35 123.31 62.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.076 0.465 . . . . 0.0 112.165 -179.224 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -67.19 -41.03 86.55 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.23 179.262 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.43 -31.89 47.33 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.205 0.526 . . . . 0.0 109.704 178.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -76.42 -32.38 58.44 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.263 178.336 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -77.21 -17.25 58.64 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.095 179.086 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -84.47 -38.68 19.84 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.339 0.59 . . . . 0.0 109.719 178.917 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.726 HD12 ' ND2' ' A' ' 29' ' ' ASN . 12.0 tp -66.86 -56.89 8.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.482 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.676 ' HB2' HG13 ' A' ' 48' ' ' VAL . . . -56.75 -33.66 66.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.149 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 m -61.27 -40.88 95.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.41 179.614 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.726 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -61.38 -43.38 98.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.45 179.655 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.95 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.39 -41.98 98.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.11 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -55.04 -35.99 65.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.137 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.4 -51.48 64.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.277 179.371 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 8.5 mmtt -62.63 -28.55 69.98 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.695 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.9 33.46 2.6 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.3 -0.863 . . . . 0.0 112.775 178.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.6 m-85 -102.37 158.92 15.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.917 0.389 . . . . 0.0 110.904 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.56 92.72 8.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.738 179.22 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 16.1 p -80.69 158.52 25.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.191 0.519 . . . . 0.0 111.339 -178.642 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.82 141.71 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.479 -178.818 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.419 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.6 t -118.84 115.84 49.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.513 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -108.68 123.68 49.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.455 179.585 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.816 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -78.07 108.8 11.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.551 ' O ' ' N ' ' A' ' 44' ' ' GLY . 4.0 tmmm? -91.17 165.61 13.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.901 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 6.4 t0 -61.17 65.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.854 0.359 . . . . 0.0 111.795 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.927 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 121.21 -15.72 9.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.787 -0.72 . . . . 0.0 113.579 179.307 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.927 HD23 ' O ' ' A' ' 44' ' ' GLY . 4.0 mt -136.27 149.71 48.6 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 117.423 0.612 . . . . 0.0 112.496 -179.234 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.744 ' CE1' HD13 ' A' ' 41' ' ' LEU . 22.9 m-85 -108.31 126.53 52.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.284 178.316 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.74 148.94 27.83 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.238 0.542 . . . . 0.0 111.752 -179.362 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.935 HG12 HD11 ' A' ' 14' ' ' ILE . 61.9 t -120.31 106.17 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.919 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.544 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.3 tt0 -105.57 139.89 39.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.001 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.95 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.88 124.03 36.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.459 0.647 . . . . 0.0 111.64 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.21 108.99 0.28 Allowed Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.197 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.445 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.12 115.49 15.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.682 0.277 . . . . 0.0 110.425 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.55 175.93 8.99 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.057 0.456 . . . . 0.0 111.564 -179.256 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 p -84.56 -18.29 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.023 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.43 128.71 56.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.865 0.364 . . . . 0.0 111.105 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.5 tmtm? -55.59 -36.42 66.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.259 -179.907 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -51.65 -32.01 27.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 4.1 m120 -70.67 -49.5 46.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.77 -41.66 91.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.082 179.656 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -59.14 -51.5 69.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.994 -179.912 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -36.71 71.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.832 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.999 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.46 -50.64 43.58 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.667 0.746 . . . . 0.0 110.15 179.543 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.753 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.44 -60.57 3.14 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.06 -177.86 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.66 -37.42 58.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.709 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -63.82 -38.51 91.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 0.0 109.804 179.031 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.3 -41.75 93.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.759 179.114 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.1 OUTLIER -62.0 -46.5 88.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.614 178.841 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.88 -25.79 64.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.642 178.253 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.85 -21.95 54.26 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.266 179.608 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.01 24.12 5.87 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.936 -0.649 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.527 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 0.9 OUTLIER -130.56 152.14 50.26 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.139 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 17.9 t70 -94.47 71.35 3.71 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.949 -0.301 . . . . 0.0 111.199 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -88.81 140.5 29.38 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 121.062 0.458 . . . . 0.0 111.667 179.654 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 13.7 pt -134.21 157.66 41.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.837 179.259 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 97.1 t -105.23 137.24 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.918 0.389 . . . . 0.0 111.158 179.888 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.5 pt -141.45 142.37 29.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.393 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.636 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.0 tp -93.72 107.24 19.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.241 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -104.38 136.84 43.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.095 -179.623 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.4 p . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.882 179.826 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.875 0.369 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -169.92 95.1 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.914 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -69.11 0.3 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.5 m 60.85 101.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 179.963 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.38 -70.35 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.941 -179.948 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.1 p -177.74 175.81 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.903 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -50.03 8.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -123.45 -145.01 6.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.374 -179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 14.7 mt -144.01 140.66 29.7 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.7 m-85 -101.4 106.8 17.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.011 0.434 . . . . 0.0 109.86 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.83 153.5 46.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.495 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.078 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.82 139.26 27.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.388 -179.942 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -130.42 137.52 49.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.586 0.232 . . . . 0.0 111.222 -179.165 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.701 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -109.92 -6.23 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.89 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.59 175.02 30.08 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 118.713 -1.708 . . . . 0.0 115.355 178.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.498 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.44 145.37 25.18 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.554 -0.823 . . . . 0.0 109.031 178.141 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.28 148.22 26.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 111.611 -179.188 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 1.7 tttt -55.61 -17.23 5.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.732 179.703 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.6 t -108.65 129.88 62.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.019 0.438 . . . . 0.0 111.948 -179.487 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -73.74 -37.68 65.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.312 179.612 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.43 64.23 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.297 0.57 . . . . 0.0 109.527 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -72.99 -32.15 64.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.986 178.107 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.44 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.4 -20.0 60.85 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.805 179.055 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -82.11 -37.33 26.46 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.726 179.835 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.5 t -69.35 -35.93 76.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.796 179.037 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.844 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -66.39 -51.75 53.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.358 179.393 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.614 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.75 -27.85 65.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.097 0.475 . . . . 0.0 110.417 179.072 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 t -67.7 -41.58 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.599 179.529 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.844 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.06 -47.63 85.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.622 179.651 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.902 ' HB1' HG21 ' A' ' 50' ' ' ILE . . . -60.64 -41.77 95.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.525 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -54.54 -36.36 64.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.244 179.587 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.41 -51.4 65.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.9 mmtt -62.67 -28.81 70.18 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.678 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.01 34.63 2.52 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.636 178.98 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.72 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -102.66 159.44 15.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.899 0.381 . . . . 0.0 110.802 179.631 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -87.6 93.82 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.252 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.614 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 41.2 p -79.02 152.87 30.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.973 -178.957 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.612 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -152.29 135.0 6.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 12.0 t -111.87 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.32 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.841 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -110.19 125.16 52.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.674 179.737 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.841 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -78.01 102.97 7.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.34 0.591 . . . . 0.0 111.191 -179.918 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.709 ' HB2' ' CE ' ' A' ' 47' ' ' LYS . 1.2 tmmm? -91.28 120.41 32.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.002 179.019 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.481 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . 38.8 t70 47.11 -84.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.765 0.317 . . . . 0.0 110.822 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.564 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -132.38 -0.53 4.53 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.222 178.911 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' ' 41' ' ' LEU . 2.0 mt -110.42 167.0 10.54 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 110.736 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.692 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.5 m-85 -119.09 137.79 53.33 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.704 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.709 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -116.27 154.08 30.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.983 0.42 . . . . 0.0 111.067 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.701 HG12 HD11 ' A' ' 14' ' ' ILE . 91.7 t -122.95 117.51 52.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.976 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.612 ' HB3' HG23 ' A' ' 38' ' ' ILE . 10.1 tt0 -119.15 143.99 46.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.344 -179.136 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.902 HG21 ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -137.28 140.87 41.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.971 178.993 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.469 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 69.38 97.14 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.971 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.89 112.52 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.166 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -135.89 171.05 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 111.633 -178.802 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -79.44 -16.42 56.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.767 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.01 132.14 56.69 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.913 0.387 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.8 ttpt -58.48 -36.74 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -46.71 -32.76 3.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.462 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 5.5 m120 -71.75 -50.08 33.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.609 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.2 -43.31 82.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.02 179.523 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.58 -51.17 71.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -57.93 -38.57 76.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.848 179.957 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.078 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.82 -52.23 39.34 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.727 0.775 . . . . 0.0 110.395 179.509 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.671 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.04 -60.73 2.91 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.18 -177.808 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.95 -36.39 49.14 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.467 179.48 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.54 -39.89 92.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.047 179.035 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.82 -41.52 95.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.591 179.113 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.4 mttm -61.87 -47.31 85.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.661 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -69.43 -25.12 63.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.703 178.637 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.497 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.63 -22.11 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.299 179.85 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.33 23.09 5.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.843 -0.694 . . . . 0.0 111.418 -179.478 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.14 148.14 51.95 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -179.248 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.442 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -91.8 74.43 5.73 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.772 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.81 140.92 29.22 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.129 0.49 . . . . 0.0 111.855 179.981 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.623 HD12 HG23 ' A' ' 76' ' ' ILE . 1.9 pp -133.49 151.46 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.957 179.196 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.609 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.7 t -101.54 136.22 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.846 0.355 . . . . 0.0 110.955 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.623 HG23 HD12 ' A' ' 74' ' ' ILE . 18.6 pt -138.95 139.16 40.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.244 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.7 tp -94.19 107.61 19.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.31 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -94.45 121.37 35.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.185 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.914 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 61.88 179.41 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -83.48 129.63 34.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.99 179.95 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.5 t 43.49 73.46 0.14 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.26 36.41 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.81 120.9 21.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.7 p -71.04 -168.9 0.32 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.977 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -105.22 -145.95 14.17 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.524 179.976 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.0 mt -143.5 139.16 29.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.798 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CE1' HD13 ' A' ' 77' ' ' LEU . 43.5 m-85 -101.28 106.01 17.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.115 0.483 . . . . 0.0 110.163 179.681 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.46 153.38 43.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.359 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.004 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.55 141.55 20.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.379 179.84 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -133.73 132.74 40.95 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.728 0.299 . . . . 0.0 111.243 -178.945 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.559 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.08 -5.9 10.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.057 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.96 173.02 29.06 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 118.951 -1.595 . . . . 0.0 114.778 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.53 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.03 137.26 18.42 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 114.986 -0.607 . . . . 0.0 109.625 178.45 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.596 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.3 m-85 -146.29 150.54 35.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.873 0.368 . . . . 0.0 111.102 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 30.6 ttmt -61.31 -12.91 15.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.937 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.36 129.46 62.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.011 0.434 . . . . 0.0 111.965 -179.402 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 ttpt -71.4 -40.1 70.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.579 179.772 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.15 -33.62 58.42 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -76.48 -32.03 58.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.354 178.349 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.613 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.04 -20.6 60.25 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.999 179.271 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.91 -38.47 21.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.693 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -67.34 -36.71 81.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 109.696 179.104 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -67.2 -51.57 51.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.253 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.573 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.57 -24.4 60.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.369 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -41.66 67.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.559 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.13 -47.06 86.67 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.391 179.816 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.74 -40.76 93.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.668 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -55.13 -36.91 66.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.203 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -51.35 62.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.24 179.422 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.542 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.48 -28.6 69.94 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.673 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.06 32.35 3.07 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.542 179.111 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.792 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.5 156.77 17.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.897 0.38 . . . . 0.0 110.776 179.506 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.27 93.63 8.73 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.66 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.626 ' HA ' HG22 ' A' ' 50' ' ' ILE . 54.1 p -80.16 156.76 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.076 0.465 . . . . 0.0 111.107 -178.638 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.13 139.13 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.716 -178.641 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.613 HG13 ' HB1' ' A' ' 23' ' ' ALA . 24.0 t -113.75 110.72 33.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.18 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.823 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -105.51 122.95 47.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.008 0.432 . . . . 0.0 110.663 179.798 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.823 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -86.76 111.62 20.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.089 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.706 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -92.38 166.18 12.7 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.358 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.484 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 3.9 t70 -57.87 67.35 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.97 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.855 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.03 -21.78 3.88 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.64 178.737 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.855 HD23 ' O ' ' A' ' 44' ' ' GLY . 36.9 mt -143.37 166.38 24.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 117.865 0.832 . . . . 0.0 112.504 -179.055 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.61 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.1 m-85 -114.79 138.75 50.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.565 178.402 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.49 157.18 29.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.031 0.443 . . . . 0.0 111.338 -179.836 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.707 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.5 t -124.67 110.99 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.407 -179.701 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.1 tt0 -110.24 141.01 43.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.422 179.821 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.11 123.1 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.45 0.643 . . . . 0.0 111.652 179.702 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.527 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.13 100.13 0.3 Allowed Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.9 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.25 123.18 40.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.369 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -142.8 170.25 16.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.122 0.486 . . . . 0.0 111.501 -179.112 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.5 p -80.47 -16.4 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.903 179.537 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.55 131.05 56.79 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.893 0.378 . . . . 0.0 110.95 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 19.5 ttpp -57.52 -36.74 71.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.404 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -46.43 -32.17 3.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.977 0.418 . . . . 0.0 110.917 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.584 ' O ' HG22 ' A' ' 61' ' ' THR . 7.9 m120 -73.79 -48.7 29.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.356 179.647 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.579 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.78 -45.62 91.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.132 179.653 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -59.07 -53.07 62.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.702 0.287 . . . . 0.0 111.22 -179.649 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.584 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.8 t -58.87 -34.4 71.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.938 0.399 . . . . 0.0 111.034 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.004 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.85 -52.95 20.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.87 0.843 . . . . 0.0 110.195 179.522 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.745 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.73 -58.49 7.01 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.97 -177.934 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.96 -37.28 60.99 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.468 179.55 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.2 ttt180 -64.16 -39.06 93.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.764 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.03 -40.44 96.33 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.45 179.075 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.02 91.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.556 178.741 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -70.25 -25.51 63.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.878 178.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -77.17 -22.96 51.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.374 179.784 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.31 23.67 5.38 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.547 -179.313 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.547 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.22 148.28 52.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 -179.245 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.3 t0 -92.31 73.72 5.32 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.779 179.594 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.96 142.86 29.34 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.082 0.468 . . . . 0.0 111.806 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.2 pt -134.66 153.06 34.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.579 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.1 t -103.75 135.38 41.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 111.073 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt -134.94 135.72 52.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.225 -179.909 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.526 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.3 tp -99.76 104.19 15.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.037 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -99.88 132.0 45.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.922 0.392 . . . . 0.0 111.201 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.9 p . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.847 179.921 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 1' ' ' LEU . 3.1 mm? . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.836 0.35 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -135.11 143.53 46.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.956 179.976 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttp 60.09 90.52 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.8 m -129.06 154.48 46.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.889 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -134.88 -46.7 0.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.917 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.3 106.11 18.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.886 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 t -164.17 -176.86 4.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.536 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -170.79 167.1 40.28 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.629 -179.984 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.7 mt -143.92 141.69 30.38 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 179.73 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.3 m-85 -101.76 106.97 18.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.163 0.506 . . . . 0.0 109.937 179.582 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.402 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.3 mttt -125.93 152.88 45.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.349 179.784 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.011 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.23 142.57 17.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.171 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -135.51 134.19 39.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.853 0.359 . . . . 0.0 111.423 -178.911 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.531 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.23 -5.65 10.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -179.328 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.78 173.97 27.88 Favored Glycine 0 C--N 1.338 0.672 0 C-N-CA 119.215 -1.469 . . . . 0.0 114.421 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.761 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 147.95 27.36 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.092 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.566 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -152.22 151.64 31.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 111.268 -179.384 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 6.2 pttp -60.89 -14.36 21.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.345 179.521 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.93 128.43 61.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.955 0.407 . . . . 0.0 111.76 -179.75 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.8 -36.86 70.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.247 179.639 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.16 -32.6 70.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 109.779 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -76.98 -34.33 57.56 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.109 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.54 -19.39 61.52 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.659 178.978 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -83.73 -38.29 21.57 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.345 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.0 t -65.28 -37.03 85.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.309 0.576 . . . . 0.0 109.644 178.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.931 HD12 ' OD1' ' A' ' 29' ' ' ASN . 40.3 tp -67.91 -48.7 65.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.137 179.172 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.62 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -57.35 -26.22 60.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.143 0.497 . . . . 0.0 110.369 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.24 -40.45 62.39 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.07 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.931 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.32 -48.55 81.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.939 0.4 . . . . 0.0 110.633 -179.977 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.956 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.46 -38.35 89.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.84 -36.64 65.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.416 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.71 -51.42 60.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.524 179.546 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.34 -28.04 69.48 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.804 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.28 33.63 2.91 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.491 179.025 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.801 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.0 157.96 16.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.687 179.356 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.37 95.92 9.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.144 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.62 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 54.7 p -80.36 155.2 27.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.17 0.51 . . . . 0.0 110.973 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.66 139.96 8.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.783 -178.643 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.594 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.34 116.4 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.497 -179.712 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.883 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -119.18 130.12 55.34 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.904 0.383 . . . . 0.0 110.337 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.883 ' N ' HD12 ' A' ' 40' ' ' LEU . 8.5 tp -90.79 115.02 27.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.01 -179.498 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.714 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.6 OUTLIER -106.16 151.94 24.09 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.372 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.468 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 30.85 -82.11 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 O-C-N 123.206 0.316 . . . . 0.0 111.154 -179.804 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.78 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -145.75 25.47 1.8 Allowed Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.288 -0.482 . . . . 0.0 111.923 178.948 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.78 HD23 ' O ' ' A' ' 44' ' ' GLY . 16.1 mt -132.02 161.54 32.93 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.989 0.424 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.642 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 27.4 m-85 -115.51 135.94 53.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.252 178.918 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.761 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.71 148.42 30.48 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 120.996 0.427 . . . . 0.0 111.114 -179.912 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.73 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.0 t -120.03 99.08 6.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.648 179.606 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.8 OUTLIER -102.56 140.84 36.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.701 -179.62 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.956 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.01 123.05 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 111.324 179.623 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.28 103.56 0.2 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.819 179.897 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -125.43 124.41 41.4 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.35 174.38 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.088 0.471 . . . . 0.0 111.606 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.17 -17.27 43.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.984 179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.6 t -112.6 128.73 56.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtt? -56.68 -34.69 67.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.225 -179.881 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.51 -32.66 28.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.853 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 31.2 m120 -70.49 -49.52 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.65 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.585 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.2 -41.56 88.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.91 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.95 -51.15 70.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.8 0.333 . . . . 0.0 110.804 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.0 m -58.66 -35.89 73.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 -180.0 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.011 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.07 -51.56 30.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.766 0.793 . . . . 0.0 110.161 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.743 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.65 -58.49 7.01 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.938 -177.993 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -36.76 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.02 -38.87 92.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.559 178.937 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.18 -40.75 94.67 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.476 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.9 mttm -62.07 -47.21 85.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.624 178.749 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -68.68 -25.89 65.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.66 178.52 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.11 -21.94 53.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.394 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.07 23.45 5.82 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.409 -179.234 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.86 148.55 52.64 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.354 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -92.21 74.52 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.08 142.29 28.81 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.082 0.468 . . . . 0.0 112.003 179.89 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 10.1 pt -135.53 153.09 32.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.062 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.3 t -103.04 135.94 38.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.903 0.382 . . . . 0.0 110.914 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt -138.8 139.9 39.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.153 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.536 HD11 ' HA3' ' A' ' 8' ' ' GLY . 13.6 tp -94.59 105.82 17.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.138 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -99.13 125.0 44.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.172 -179.651 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.959 179.926 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.744 0.307 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -90.2 -59.39 2.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.802 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -121.2 165.28 15.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.971 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.7 175.27 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.863 179.917 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 106.94 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.2 m -128.24 23.43 6.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.133 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.1 m 54.32 -179.04 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.927 0.394 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -117.9 -143.39 7.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.377 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 22.6 mt -144.11 139.74 29.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.491 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -101.04 106.73 18.04 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.423 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -126.51 155.85 41.69 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.532 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.056 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.68 138.28 34.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.29 179.845 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -130.49 134.98 47.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.767 0.318 . . . . 0.0 111.104 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.559 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.27 -5.25 10.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.145 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.62 171.15 28.45 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 119.15 -1.5 . . . . 0.0 114.687 179.003 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.62 140.95 22.33 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.476 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.526 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.6 m-85 -149.85 149.62 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.0 111.361 -179.323 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.14 -15.41 23.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.525 179.843 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -104.93 128.66 58.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.041 0.448 . . . . 0.0 111.765 -179.711 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.84 -38.92 70.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.452 179.772 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -32.39 65.24 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.168 0.509 . . . . 0.0 109.85 179.153 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.68 -33.86 53.15 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.25 178.511 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.53 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.8 -22.48 61.57 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.806 179.116 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -81.66 -38.83 25.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -64.0 -37.54 87.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.319 0.58 . . . . 0.0 109.72 179.021 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.959 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.5 tp -67.62 -46.33 72.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.206 179.357 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.538 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.49 -26.35 65.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.119 0.485 . . . . 0.0 110.631 179.187 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -74.82 -40.62 60.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.071 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.959 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.72 -48.58 81.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.911 0.386 . . . . 0.0 110.747 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.61 -38.3 89.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.333 179.472 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -55.18 -36.61 66.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.481 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.5 -50.29 65.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.388 179.442 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 6.1 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.709 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 32.65 3.1 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.554 179.058 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.2 m-85 -100.89 156.8 17.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.93 0.395 . . . . 0.0 110.72 179.639 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.52 94.19 8.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.009 179.422 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.57 ' HA ' HG22 ' A' ' 50' ' ' ILE . 86.3 p -80.24 155.98 27.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.114 0.483 . . . . 0.0 110.968 -178.815 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.568 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.22 142.33 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.761 -178.525 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 35.4 t -120.21 117.86 54.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.366 -179.759 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.75 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -118.5 133.95 55.47 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.981 0.42 . . . . 0.0 110.572 179.681 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.824 HD22 ' CZ ' ' A' ' 46' ' ' TYR . 15.0 tp -93.81 115.54 27.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.683 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.5 OUTLIER -102.69 161.22 13.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.476 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.636 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 16.7 -82.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.818 0.342 . . . . 0.0 111.159 -179.492 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.735 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -141.21 26.31 2.46 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.004 178.569 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.792 ' O ' HD12 ' A' ' 41' ' ' LEU . 19.7 mt -130.61 156.86 44.16 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.016 0.436 . . . . 0.0 111.429 -179.83 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.824 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 31.0 m-85 -113.02 132.7 55.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.324 178.99 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.816 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.48 149.45 27.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.983 0.421 . . . . 0.0 111.528 -179.85 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.814 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.9 t -121.81 100.97 9.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.29 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -106.84 141.9 37.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.543 -178.831 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.78 123.48 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-O 121.469 0.652 . . . . 0.0 111.414 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.69 105.33 0.25 Allowed Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.004 179.671 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.44 115.49 18.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.628 0.252 . . . . 0.0 110.429 179.525 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.56 171.04 14.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.045 0.45 . . . . 0.0 111.544 -179.328 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.99 -18.33 50.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.02 133.05 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.934 0.397 . . . . 0.0 111.089 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.491 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 7.7 ttpt -58.82 -38.27 78.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.443 -179.708 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.01 -32.23 2.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.998 0.427 . . . . 0.0 110.839 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.45 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 32.7 m120 -72.52 -49.23 34.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.413 179.638 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.637 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.97 -44.66 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.255 179.657 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -59.17 -50.78 72.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 4.6 m -58.9 -36.23 74.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.793 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.056 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.34 -51.69 34.48 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.808 0.813 . . . . 0.0 110.293 179.446 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.1 -59.25 4.9 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.039 -177.983 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.41 -36.17 53.55 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.37 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.6 ttt180 -65.29 -38.95 91.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.727 178.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.72 -41.69 91.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.645 178.965 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.577 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.87 87.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.165 0.507 . . . . 0.0 109.662 178.773 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -69.34 -25.77 64.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.753 178.534 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.9 -22.65 53.08 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.91 23.9 5.41 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.481 -179.303 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.577 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.81 148.73 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.325 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.465 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.3 t0 -92.54 75.41 5.11 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.936 179.965 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.55 141.4 29.07 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 121.228 0.537 . . . . 0.0 111.931 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.6 pt -133.68 151.02 32.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.984 179.122 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.637 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.2 t -101.33 137.88 27.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.938 0.399 . . . . 0.0 111.03 -179.944 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 pt -138.71 136.89 43.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.179 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.458 HD13 ' CE1' ' A' ' 10' ' ' TYR . 14.8 tp -102.97 106.69 17.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.41 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -104.43 131.02 52.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.94 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.854 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.83 0.347 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -135.42 -46.88 0.69 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.967 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.2 86.64 3.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.921 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 t -134.04 111.37 10.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.911 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -120.98 143.92 48.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.867 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.88 -26.68 12.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.962 179.965 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t 66.51 47.13 1.73 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.912 179.932 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -98.8 -163.75 30.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.305 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt -144.21 139.62 28.81 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.878 0.371 . . . . 0.0 110.348 179.834 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.836 ' CE1' HD13 ' A' ' 77' ' ' LEU . 42.7 m-85 -101.69 106.25 17.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.838 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.485 ' HD3' ' NE2' ' A' ' 49' ' ' GLN . 19.1 mttt -125.11 152.32 44.55 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.473 179.846 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.041 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.17 139.87 24.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.197 179.712 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -132.61 134.56 45.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.792 0.33 . . . . 0.0 111.282 -179.135 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.578 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.77 -5.74 10.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.234 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.13 172.62 27.6 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 119.18 -1.486 . . . . 0.0 114.707 178.884 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.773 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.54 147.95 27.42 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.025 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.545 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.3 m-85 -152.21 153.11 33.16 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.485 -179.293 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.412 ' CG ' HD22 ' A' ' 45' ' ' LEU . 3.6 mtpp -59.8 -17.29 34.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.295 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.04 130.63 57.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.046 0.45 . . . . 0.0 111.915 -179.394 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -72.92 -38.21 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.231 179.515 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.18 66.24 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.893 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -75.46 -33.61 60.86 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.099 178.22 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.567 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.33 -20.81 61.42 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.649 179.054 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.4 -37.48 25.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.47 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.5 t -66.19 -37.23 85.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.772 179.085 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.935 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.19 -47.06 68.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.259 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.674 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.87 -26.07 65.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.055 0.455 . . . . 0.0 110.349 178.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.54 61.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.091 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.935 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.64 -48.34 82.05 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 120.863 0.363 . . . . 0.0 110.616 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.58 -38.33 89.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.243 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -54.74 -36.61 64.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.387 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.67 -51.22 61.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.472 179.483 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.45 -28.2 69.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.73 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.44 33.24 2.97 Favored Glycine 0 N--CA 1.444 -0.775 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.44 179.025 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.732 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.9 m-85 -100.47 156.93 17.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.917 0.389 . . . . 0.0 110.628 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.96 95.21 8.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.935 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.674 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 51.5 p -80.14 155.01 27.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.174 0.512 . . . . 0.0 110.88 -178.801 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.55 139.34 8.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 -178.47 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.61 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.3 t -117.13 116.04 50.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.505 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.915 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -117.26 128.17 54.81 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.875 0.369 . . . . 0.0 110.436 179.815 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.915 ' N ' HD12 ' A' ' 40' ' ' LEU . 7.3 tp -90.75 116.76 28.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.891 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.657 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -109.64 145.96 35.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.554 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 36.79 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 O-C-N 123.169 0.293 . . . . 0.0 110.562 -178.953 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.657 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -140.12 8.9 2.99 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.419 178.866 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.597 ' O ' HD12 ' A' ' 41' ' ' LEU . 13.4 mt -114.13 159.37 20.14 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 111.399 179.833 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.86 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 27.8 m-85 -115.56 135.84 53.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.848 178.797 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.773 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.22 148.97 29.19 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 111.266 -179.749 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.745 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.9 t -121.62 99.41 7.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.579 179.666 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.619 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.3 tt0 -104.02 142.25 34.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.907 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.39 123.25 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.623 0.725 . . . . 0.0 111.281 179.423 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.13 101.62 0.23 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.768 -1.106 . . . . 0.0 112.888 179.726 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.451 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -124.99 116.42 22.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.664 0.269 . . . . 0.0 110.399 179.493 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.29 171.09 14.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.084 0.469 . . . . 0.0 111.637 -179.209 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.4 p -80.43 -17.86 50.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.956 179.556 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -113.41 131.75 55.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.947 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 14.7 ttpt -57.64 -39.35 76.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.488 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -45.88 -32.1 2.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.02 0.438 . . . . 0.0 110.927 -179.85 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 34.9 m120 -72.15 -49.41 36.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.308 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.628 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.49 -43.86 84.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.066 179.645 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.11 -49.81 76.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.872 0.368 . . . . 0.0 110.933 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.46 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.8 m -59.46 -36.06 75.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.041 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.0 -52.74 21.71 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 121.792 0.806 . . . . 0.0 110.282 179.479 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.742 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.98 -58.22 8.12 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.982 -177.917 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.89 -37.0 60.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.348 179.361 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.74 -39.79 94.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.715 179.016 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.69 -40.93 96.23 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.572 179.009 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.3 OUTLIER -62.13 -46.99 86.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.562 178.834 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -69.44 -25.57 64.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.791 178.618 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.82 -22.6 53.37 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.459 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 23.49 5.66 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 -179.325 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.555 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.66 148.4 52.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.386 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.6 t70 -91.98 74.65 5.59 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.79 140.39 30.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.085 0.469 . . . . 0.0 111.88 179.962 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.429 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.4 pt -132.66 151.97 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.925 179.098 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.628 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.3 t -102.61 137.14 31.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.893 0.378 . . . . 0.0 111.114 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 11.0 tt -137.11 135.0 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.962 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.836 HD13 ' CE1' ' A' ' 10' ' ' TYR . 13.5 tp -95.57 106.09 18.14 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.071 179.841 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -90.79 103.39 16.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.985 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.878 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt . . . . . 0 CA--C 1.516 -0.349 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.1 m-85 -101.79 105.91 16.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.069 0.461 . . . . 0.0 110.186 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 19.0 mttt -125.21 151.91 45.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.332 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -103.85 142.62 17.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.184 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -136.33 131.94 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.863 0.363 . . . . 0.0 111.342 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.536 HD13 HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -105.36 -5.46 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.69 173.54 28.3 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 119.236 -1.459 . . . . 0.0 114.43 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.725 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.41 142.74 23.38 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.605 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -147.75 150.62 34.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.038 0.447 . . . . 0.0 111.405 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -60.54 -15.07 23.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.415 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.4 t -106.54 129.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 121.112 0.482 . . . . 0.0 111.785 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.2 ttpt -71.88 -39.17 69.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.512 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.72 -32.0 66.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.132 0.491 . . . . 0.0 109.827 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -77.51 -34.43 54.04 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.259 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -19.49 60.98 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.839 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.67 -38.34 21.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -38.03 88.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.803 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.5 tp -65.95 -50.06 65.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.217 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.54 -24.32 60.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.485 179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.85 -41.5 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.612 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.803 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -58.68 -47.38 84.68 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.513 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.51 -40.29 94.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.522 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.71 -37.31 65.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.304 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.32 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.36 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -62.5 -28.48 69.87 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.66 32.92 3.0 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.54 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.799 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -100.35 155.88 17.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -85.02 94.51 8.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.8 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.591 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.6 p -80.17 156.0 27.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.175 0.512 . . . . 0.0 111.017 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.66 137.71 7.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.913 -178.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 47.5 t -114.98 113.86 44.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.028 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.594 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.006 0.431 . . . . 0.0 110.499 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.45 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.9 m-85 . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.725 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.88 148.24 29.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.129 0.49 . . . . 0.0 111.815 -179.243 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.743 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.2 t -120.77 101.62 10.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.787 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.646 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.9 tt0 -107.5 142.19 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.864 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.13 123.07 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.518 0.675 . . . . 0.0 111.449 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.552 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.11 105.57 0.22 Allowed Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.865 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.571 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.1 124.87 40.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.647 0.261 . . . . 0.0 110.505 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.69 172.99 11.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.136 0.493 . . . . 0.0 111.499 -179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -83.04 -15.92 49.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.997 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 128.52 56.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.898 0.38 . . . . 0.0 111.028 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -56.32 -34.92 67.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.212 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.48 -30.88 32.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.443 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 63.9 m-80 -70.8 -50.24 37.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.681 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.599 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.75 -40.2 87.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.926 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -60.47 -51.47 69.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -59.02 -35.98 74.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.63 -52.04 29.52 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.846 0.831 . . . . 0.0 110.131 179.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.69 -59.05 5.11 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.993 -177.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.6 -36.75 56.9 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.522 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.5 ttt180 -64.33 -38.72 92.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.766 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.94 -40.88 95.71 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.543 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.9 mttm -61.86 -46.88 87.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.678 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.52 -25.69 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.817 178.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.475 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.08 -22.54 52.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.4 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.1 23.93 5.34 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.581 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.41 148.46 52.66 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.6 t70 -92.33 74.32 5.3 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.579 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.33 142.9 29.85 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-O 121.234 0.54 . . . . 0.0 111.845 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.51 152.74 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.016 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.8 t -104.91 134.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.902 0.382 . . . . 0.0 110.848 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.5 tt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.286 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.516 -0.341 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.9 m-85 -101.7 105.74 16.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.127 0.489 . . . . 0.0 110.241 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -125.4 157.3 37.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.019 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -110.57 136.24 47.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.356 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.096 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.5 135.32 47.83 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 111.453 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.652 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.32 -6.16 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.47 177.0 29.21 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 119.176 -1.488 . . . . 0.0 114.595 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.646 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 144.05 24.12 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.635 ' HE1' HD22 ' A' ' 26' ' ' LEU . 5.0 m-85 -147.86 149.65 32.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.382 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -14.31 26.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.47 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 125.28 62.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.041 0.448 . . . . 0.0 111.985 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.2 tmtt? -67.11 -41.01 86.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.492 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.65 66.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.118 0.485 . . . . 0.0 109.906 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -77.93 -35.46 50.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.391 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.98 -19.08 61.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.802 179.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.53 -37.51 21.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.639 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -37.33 86.14 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.826 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.5 tp -66.82 -51.01 60.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.999 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.15 -24.62 59.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.599 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -72.53 -41.41 65.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.519 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.826 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.89 -47.71 84.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.588 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.87 -40.91 94.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.597 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -55.22 -37.14 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.382 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.91 -50.85 65.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.235 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.7 mmtt -62.45 -28.53 69.87 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.5 31.52 3.21 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.519 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.6 m-85 -100.49 157.26 16.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 0.0 110.794 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -86.81 93.98 9.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.758 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.621 ' HA ' HG22 ' A' ' 50' ' ' ILE . 99.2 p -80.29 157.78 26.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.138 0.494 . . . . 0.0 110.918 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.525 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.27 138.51 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.01 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.592 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.1 t -117.41 116.71 52.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.023 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.602 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.0 110.692 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 m-85 . . . . . 0 C--O 1.23 0.062 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.88 146.55 28.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.126 0.489 . . . . 0.0 111.722 -179.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.784 ' CB ' HD23 ' A' ' 26' ' ' LEU . 99.4 t -120.99 102.59 12.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.678 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.525 ' HB3' HG23 ' A' ' 38' ' ' ILE . 36.3 tt0 -111.38 143.76 41.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.274 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.38 123.82 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.525 0.679 . . . . 0.0 111.454 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.53 109.78 0.29 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.04 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -132.85 122.38 24.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.747 0.308 . . . . 0.0 110.259 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.66 175.44 9.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.071 0.462 . . . . 0.0 111.621 -179.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.65 -15.38 39.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.124 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.7 t -112.07 126.94 55.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -55.63 -36.28 66.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.178 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -53.04 -30.05 33.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.904 0.383 . . . . 0.0 110.99 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.474 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 2.7 m-80 -72.84 -49.37 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.741 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.456 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.81 -40.96 94.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.003 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -60.38 -49.99 75.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.824 0.345 . . . . 0.0 110.83 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.7 m -58.01 -37.77 74.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.783 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.019 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.8 -50.42 50.42 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.782 0.801 . . . . 0.0 110.177 179.297 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.2 -60.81 2.82 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.306 -1.315 . . . . 0.0 111.098 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.7 54.28 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.691 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.46 -38.02 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.75 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.67 -41.71 92.15 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.714 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.3 mttm -62.04 -46.37 89.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.597 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.28 -25.73 63.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.737 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.485 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.23 -23.83 54.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.8 24.51 4.9 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.546 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.68 149.03 52.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.26 72.51 4.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.83 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 144.75 26.52 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.07 0.462 . . . . 0.0 111.69 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.0 pp -133.43 157.67 42.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.756 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 12' ' ' VAL . 84.0 t -109.84 134.68 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.976 0.417 . . . . 0.0 111.029 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 74' ' ' ILE . 1.7 pt . . . . . 0 C--O 1.237 0.41 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.364 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mp . . . . . 0 CA--C 1.517 -0.307 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.514 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.2 m-85 -101.92 106.61 17.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.077 0.465 . . . . 0.0 110.05 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.0 mttt -126.45 155.36 42.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.644 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.036 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.27 137.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.395 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -129.96 135.82 48.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.572 0.225 . . . . 0.0 110.996 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.22 -6.35 11.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -179.124 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.91 174.34 28.49 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 119.047 -1.549 . . . . 0.0 114.781 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.715 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.8 143.33 23.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -145.89 149.15 33.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 111.323 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.488 ' HG3' HG23 ' A' ' 19' ' ' VAL . 4.7 ptpp? -61.7 -13.56 23.93 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.345 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.488 HG23 ' HG3' ' A' ' 18' ' ' LYS . 21.3 t -107.43 126.44 63.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.061 0.458 . . . . 0.0 111.94 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 46' ' ' TYR . 5.5 tmtt? -65.87 -42.19 90.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.591 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.54 -33.13 65.8 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.166 0.508 . . . . 0.0 109.895 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -77.16 -36.21 55.37 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.44 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.84 62.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.666 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -35.73 26.88 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 t -64.87 -36.69 85.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.964 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.48 -50.98 48.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.383 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -56.89 -25.25 56.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.067 0.46 . . . . 0.0 110.592 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -41.37 60.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.761 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.964 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.04 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.845 0.355 . . . . 0.0 110.401 179.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.978 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.71 -40.35 87.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.308 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -55.37 -36.45 66.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.88 -51.74 54.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.354 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -62.83 -28.49 70.05 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.5 34.25 2.92 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.502 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.77 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.6 m-85 -100.84 156.12 17.55 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.126 0.488 . . . . 0.0 110.92 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.33 89.92 7.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.529 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.657 ' HA ' HG22 ' A' ' 50' ' ' ILE . 1.1 m -80.33 158.68 26.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 110.526 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.501 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -156.87 141.64 8.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.17 -178.372 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 58.8 t -117.81 116.5 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.005 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.597 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.813 0.339 . . . . 0.0 110.658 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 20' ' ' LYS . 25.0 m-85 . . . . . 0 N--CA 1.457 -0.08 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.06 147.92 27.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.175 0.512 . . . . 0.0 111.744 -179.307 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.783 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.5 t -123.08 103.41 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 38' ' ' ILE . 12.5 tt0 -108.97 143.18 38.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.123 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.978 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.9 pp -135.27 123.89 40.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.519 0.676 . . . . 0.0 111.574 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.409 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.73 104.98 0.25 Allowed Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.913 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.01 112.78 14.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.709 0.29 . . . . 0.0 110.339 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.9 171.13 14.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 0.0 111.467 -179.302 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -81.42 -16.44 52.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.007 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.34 131.47 56.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.869 0.366 . . . . 0.0 111.07 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.0 ttpt -58.14 -37.76 75.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.314 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -46.32 -32.54 3.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.094 0.473 . . . . 0.0 110.825 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.461 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 10.4 m120 -73.46 -48.83 30.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.28 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.79 -45.53 89.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.163 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.83 -51.1 71.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 71.5 m -59.19 -35.67 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.884 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.036 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.51 -51.92 31.33 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 121.815 0.817 . . . . 0.0 110.129 179.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -59.69 4.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.021 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.06 46.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.387 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt-85 -65.33 -39.9 93.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.88 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.18 -40.97 97.21 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.703 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 40.6 mttm -62.34 -46.85 86.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.664 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.53 -25.44 64.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.794 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.81 -22.49 53.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.368 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.19 23.92 5.61 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.73 149.0 52.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.255 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 31.2 t0 -92.25 74.23 5.37 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.821 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.67 140.51 30.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.088 0.471 . . . . 0.0 111.842 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pt -132.66 149.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.085 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 91.7 t -102.78 135.8 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 0.0 110.969 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 pt . . . . . 0 C--O 1.236 0.365 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.411 -179.93 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 CA--C 1.516 -0.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.1 m-85 -101.4 106.45 17.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.312 -0.403 . . . . 0.0 109.987 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttm -126.03 155.7 41.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.007 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.25 142.77 19.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.211 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.301 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 3.6 tt0 -135.15 132.83 38.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 111.166 -179.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.539 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.09 -5.39 10.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.83 174.1 28.09 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 119.209 -1.472 . . . . 0.0 114.562 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.76 143.85 23.9 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.364 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.572 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -147.37 151.45 36.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.374 . . . . 0.0 111.286 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -61.14 -15.57 34.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.385 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.4 t -105.8 128.4 60.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 121.032 0.444 . . . . 0.0 112.073 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.4 tmtt? -68.62 -42.59 77.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.481 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.44 -31.29 61.78 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.128 0.489 . . . . 0.0 109.95 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -77.94 -35.2 50.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.464 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.67 -21.19 61.84 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.12 -37.55 23.62 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.441 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -65.15 -36.11 83.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.23 0.538 . . . . 0.0 109.612 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.5 tp -69.07 -48.2 63.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.286 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.401 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.16 -25.93 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.064 0.459 . . . . 0.0 110.426 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.2 t -75.1 -40.63 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.36 -48.25 82.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.921 0.391 . . . . 0.0 110.709 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.92 -38.38 90.73 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.352 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.76 -36.41 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.323 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -50.99 64.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.513 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 9.6 mmpt? -62.2 -28.01 69.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.37 32.39 3.22 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.421 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -99.64 154.76 18.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.01 0.433 . . . . 0.0 110.751 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.39 92.58 7.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.751 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 98.0 p -79.95 156.06 27.41 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.036 0.446 . . . . 0.0 110.967 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.632 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.65 141.47 7.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.772 -178.401 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.597 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.4 t -120.02 119.13 59.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.295 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.593 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 110.394 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 27.7 m-85 . . . . . 0 C--O 1.228 -0.028 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.713 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.7 149.3 27.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 111.79 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.797 ' HB ' HD23 ' A' ' 26' ' ' LEU . 61.8 t -123.0 104.36 14.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.683 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.632 ' HB3' HG23 ' A' ' 38' ' ' ILE . 4.8 tt0 -109.39 142.75 39.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.117 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.04 123.66 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-O 121.551 0.691 . . . . 0.0 111.592 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.91 103.91 0.26 Allowed Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.991 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.441 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -125.31 122.69 37.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.85 172.02 13.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.485 . . . . 0.0 111.567 -179.042 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.41 -16.97 47.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.005 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.12 130.8 56.57 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.827 0.346 . . . . 0.0 111.095 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.6 ttpt -57.95 -38.03 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.359 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -46.46 -31.31 2.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.967 0.413 . . . . 0.0 110.775 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.637 ' O ' HG22 ' A' ' 61' ' ' THR . 3.7 m-80 -74.07 -48.69 28.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.379 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.13 -44.63 94.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.155 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -59.07 -52.01 67.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.125 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.9 t -59.49 -34.15 72.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.925 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.007 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -51.88 28.58 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.701 0.763 . . . . 0.0 109.932 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.738 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.11 8.57 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.878 -177.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.43 -35.96 61.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt180 -64.91 -39.48 93.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.682 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.91 -40.75 95.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.584 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 26.3 mttm -61.98 -47.34 85.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.706 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.78 -25.92 64.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.83 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.501 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.98 -21.9 54.0 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.388 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.92 23.91 5.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.484 -179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.573 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.01 148.89 52.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 28.1 t70 -92.37 74.58 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.926 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.13 142.0 29.81 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.104 0.478 . . . . 0.0 111.868 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.3 pt -133.77 151.47 33.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.881 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.521 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.7 t -104.68 134.6 45.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.978 0.418 . . . . 0.0 111.05 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.409 HD13 ' C ' ' A' ' 76' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.019 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.0 mt . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.511 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.3 m-85 -102.0 105.64 16.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.011 0.434 . . . . 0.0 110.109 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -124.99 156.36 38.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.437 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -110.5 138.14 39.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.318 179.865 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 14.0 tt0 -132.22 136.48 47.03 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.888 0.375 . . . . 0.0 111.167 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.66 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.02 -5.39 10.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -179.085 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.38 173.45 28.95 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 118.942 -1.599 . . . . 0.0 114.93 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.785 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.4 142.7 23.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.958 -0.621 . . . . 0.0 109.472 178.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.579 ' CE1' HD22 ' A' ' 26' ' ' LEU . 2.5 m-85 -146.16 149.23 33.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.878 0.37 . . . . 0.0 111.254 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -60.81 -15.31 28.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.419 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.83 130.27 60.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.637 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -69.43 -40.15 77.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.633 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -35.54 66.11 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.286 0.565 . . . . 0.0 109.619 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -73.99 -34.2 64.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.209 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.45 -19.74 61.51 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.761 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -35.49 25.58 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.474 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 t -67.68 -38.92 84.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 0.0 109.724 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.728 HD23 ' HB ' ' A' ' 48' ' ' VAL . 20.4 tp -65.84 -53.29 41.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.379 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.35 -24.52 63.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -70.85 -42.39 70.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.537 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.724 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.89 -46.25 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.518 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.997 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.668 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.43 -37.18 67.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.149 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.94 -49.99 67.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.268 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.83 -29.04 70.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.423 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.14 32.92 2.89 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.539 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.758 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.9 m-85 -101.47 158.36 16.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.053 0.454 . . . . 0.0 110.544 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -87.27 94.86 9.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.634 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.607 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 35.0 p -80.07 157.38 26.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.845 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.59 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.91 137.43 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.752 -178.472 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.7 t -114.22 112.83 41.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.199 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.599 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 CA--C 1.521 -0.165 0 CA-C-O 121.013 0.435 . . . . 0.0 110.921 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.1 m-85 . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.38 148.84 28.57 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.156 0.503 . . . . 0.0 111.993 -179.558 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.728 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.9 t -121.89 99.01 6.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.307 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.59 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.2 tt0 -106.42 143.04 35.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.075 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.997 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.75 123.35 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 111.513 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.76 110.12 0.3 Allowed Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 114.763 -1.108 . . . . 0.0 113.053 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -134.66 112.91 11.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.744 0.307 . . . . 0.0 110.52 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.5 174.53 10.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.039 0.447 . . . . 0.0 111.57 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -84.73 -16.24 42.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.19 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.68 128.3 56.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.9 0.381 . . . . 0.0 111.044 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.511 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.0 -36.86 65.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.228 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -53.01 -30.23 34.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.439 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -72.18 -49.21 37.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.803 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.99 -41.2 97.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.002 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.61 -50.99 71.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.971 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.2 m -57.12 -37.64 72.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.811 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -50.1 53.82 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.737 0.78 . . . . 0.0 110.279 179.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.733 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.93 -60.64 3.06 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.166 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.74 59.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -63.88 -40.11 95.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.068 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.43 -40.5 95.87 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.69 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 33.3 mttm -62.03 -46.77 87.74 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -69.32 -26.37 64.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.826 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.61 -22.44 54.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.411 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.73 24.19 5.35 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.568 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.74 148.91 52.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 36.4 t70 -92.63 72.71 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.6 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.16 141.87 29.88 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.149 0.499 . . . . 0.0 111.745 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 7.6 pt -133.11 154.75 40.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.925 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.639 HG22 HG13 ' A' ' 12' ' ' VAL . 92.1 t -108.48 135.82 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.953 0.406 . . . . 0.0 110.881 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 pt . . . . . 0 C--O 1.237 0.425 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.562 -179.725 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.605 HD13 ' HZ1' ' A' ' 11' ' ' LYS . 1.4 mt . . . . . 0 CA--C 1.516 -0.341 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.9 m-85 -101.96 105.84 16.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.044 0.449 . . . . 0.0 110.214 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.605 ' HZ1' HD13 ' A' ' 9' ' ' LEU . 2.5 mttm -125.83 153.01 44.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.448 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.027 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.7 136.37 41.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.372 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.358 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.19 135.38 48.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.598 0.237 . . . . 0.0 111.021 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.573 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -6.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.789 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.41 172.09 29.4 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 118.834 -1.65 . . . . 0.0 114.885 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.55 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.92 138.1 19.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.849 -0.675 . . . . 0.0 109.486 178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -148.72 150.76 33.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 111.079 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.9 tttt -61.21 -12.65 13.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.068 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -109.13 129.9 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 111.907 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.7 -38.35 67.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.592 179.811 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.8 -34.86 63.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.328 0.585 . . . . 0.0 109.634 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -75.4 -31.87 60.56 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.178 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.36 -18.86 60.62 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.93 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -84.71 -38.18 20.04 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.634 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -68.43 -35.73 78.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 109.588 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.829 HD12 ' ND2' ' A' ' 29' ' ' ASN . 56.7 tp -68.14 -51.99 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.119 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.97 -24.43 62.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.408 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.7 m -71.32 -41.27 70.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.5 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.829 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.64 -46.93 87.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.446 179.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.949 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.67 -41.45 90.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.556 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -55.63 -36.83 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.233 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.38 -51.19 63.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.393 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.6 mmpt? -62.73 -28.54 70.03 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.91 32.8 2.98 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.513 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.783 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -101.16 157.62 16.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 110.809 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.41 92.23 8.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.656 ' HA ' HG22 ' A' ' 50' ' ' ILE . 77.3 p -80.35 156.66 26.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.142 0.496 . . . . 0.0 111.033 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.89 141.86 5.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.527 -178.84 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.559 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.0 t -114.65 111.68 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.175 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.605 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 120.918 0.39 . . . . 0.0 110.511 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.6 m-85 . . . . . 0 C--O 1.228 -0.057 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -122.23 158.89 28.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.652 HG21 ' HB3' ' A' ' 26' ' ' LEU . 93.0 t -122.99 114.08 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.296 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.572 ' HB3' HG23 ' A' ' 38' ' ' ILE . 23.2 tt0 -112.45 137.52 50.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.797 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.949 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.54 123.97 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.625 0.726 . . . . 0.0 111.488 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.55 102.35 0.21 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.085 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.11 120.99 31.6 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -141.04 174.32 10.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.153 0.501 . . . . 0.0 111.589 -179.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.1 m -84.72 -15.76 44.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.001 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -112.42 128.08 56.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.79 0.329 . . . . 0.0 111.098 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -56.6 -35.18 67.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.27 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -51.86 -31.5 28.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.85 0.357 . . . . 0.0 110.98 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 9.9 m-80 -71.98 -49.74 34.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.577 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.95 -42.24 93.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.17 -50.93 71.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.819 0.342 . . . . 0.0 110.793 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.8 m -58.54 -37.12 75.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.824 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.027 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.52 -51.27 44.86 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.752 0.787 . . . . 0.0 110.154 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.39 -59.97 3.97 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.091 -177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.31 -36.62 43.51 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -65.69 -39.53 91.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.836 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.0 -41.88 94.97 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.562 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.0 mmmm -61.79 -46.8 87.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.795 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -69.85 -25.55 63.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.747 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.469 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.38 -22.43 54.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.381 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.94 23.39 5.59 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.446 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.39 147.6 52.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 33.8 t70 -91.02 73.36 6.41 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.675 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.6 140.55 30.5 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.105 0.478 . . . . 0.0 111.871 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 pt -132.53 151.15 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.833 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.504 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.4 t -103.95 135.72 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.858 0.361 . . . . 0.0 110.982 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.0 pt . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.249 -179.802 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.515 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.5 m-85 -101.94 105.72 16.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.035 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.49 152.98 44.24 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.35 137.72 35.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.131 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -132.96 134.47 44.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.698 0.285 . . . . 0.0 111.253 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.581 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.86 -4.79 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.96 174.7 29.01 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 119.135 -1.507 . . . . 0.0 114.766 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.76 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.19 141.78 22.63 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.621 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -147.87 149.8 32.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.025 0.441 . . . . 0.0 111.351 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 tttt -61.58 -13.74 24.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -106.58 126.18 62.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.794 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.12 -40.57 82.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.469 179.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.49 -32.27 64.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.263 0.554 . . . . 0.0 109.9 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -77.54 -34.01 54.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.395 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.506 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.92 -19.54 60.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.849 179.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.43 -37.49 21.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.562 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -38.63 88.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.297 0.57 . . . . 0.0 109.63 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 40.5 tp -66.09 -51.48 57.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.188 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.524 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.19 -23.93 57.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.543 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.1 m -73.0 -41.32 64.42 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.677 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.27 -47.16 86.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.604 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.68 -40.61 95.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.578 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -55.14 -37.24 66.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.283 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.76 -49.93 69.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.27 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -62.39 -28.49 69.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.93 31.43 3.36 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.555 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.781 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.1 156.07 17.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.92 0.39 . . . . 0.0 110.799 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.88 93.13 8.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.696 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.0 p -80.28 157.22 26.49 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 121.128 0.489 . . . . 0.0 110.926 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.95 139.66 6.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.705 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.5 t -116.41 115.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.219 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.597 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.812 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 29.6 m-85 . . . . . 0 N--CA 1.462 0.137 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.76 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.55 148.65 28.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.179 0.514 . . . . 0.0 111.84 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.789 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.8 t -120.54 100.41 9.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.393 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.556 ' HB3' HG23 ' A' ' 38' ' ' ILE . 31.5 tt0 -108.97 142.39 39.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.319 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -136.31 122.98 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.538 0.685 . . . . 0.0 111.657 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.16 107.67 0.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.912 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.12 118.59 21.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.651 0.262 . . . . 0.0 110.428 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -138.31 172.79 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 111.48 -179.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -84.15 -15.49 46.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.092 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.29 128.81 56.38 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.0 tmtm? -55.65 -35.58 66.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.275 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -53.17 -29.96 34.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.455 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 26.4 m120 -71.56 -49.85 36.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.721 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.515 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.99 -40.87 95.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.061 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.2 -50.96 71.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.741 0.305 . . . . 0.0 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 13.6 m -58.59 -37.46 75.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.58 -51.03 47.03 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.732 0.777 . . . . 0.0 110.085 179.449 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.36 -59.99 3.95 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.093 -177.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.84 -36.05 46.77 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.43 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.98 -38.74 89.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.871 178.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.14 96.28 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.662 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -62.27 -46.25 89.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.722 178.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -25.54 63.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.694 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.481 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.45 -23.64 53.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.35 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.9 23.38 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.552 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.549 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.67 148.26 52.44 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 45.6 t0 -91.79 74.03 5.75 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.644 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.07 142.29 30.52 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.066 0.46 . . . . 0.0 111.956 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.4 pt -133.12 151.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.8 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.515 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.5 t -105.42 135.41 43.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.393 . . . . 0.0 111.125 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 30.1 pt . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.221 -179.842 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 9' ' ' LEU . 3.4 mm? . . . . . 0 CA--C 1.515 -0.397 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -100.93 106.77 18.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.195 0.522 . . . . 0.0 110.17 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.406 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 6.7 mttm -125.85 152.97 44.79 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.403 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.032 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.18 140.57 22.81 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.209 179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.421 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 42.2 tt0 -132.92 131.81 41.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.717 0.294 . . . . 0.0 111.281 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.569 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.02 -5.57 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -179.284 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.19 172.28 28.31 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 119.104 -1.522 . . . . 0.0 114.634 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.763 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 141.07 22.09 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 114.884 -0.658 . . . . 0.0 109.254 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.581 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.3 m-85 -146.63 150.28 35.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.913 0.387 . . . . 0.0 111.357 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -13.81 22.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.424 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.45 128.5 60.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.046 0.451 . . . . 0.0 111.989 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 7.2 tmtt? -69.34 -41.13 77.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.487 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.74 -31.06 64.18 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.171 0.51 . . . . 0.0 109.924 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -78.07 -35.1 49.9 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.335 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.56 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.32 -22.99 61.85 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.772 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -38.66 26.85 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.531 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -63.67 -37.73 88.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.228 0.537 . . . . 0.0 109.653 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.2 tp -67.31 -46.03 74.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.198 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -59.39 -26.59 65.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.462 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -41.05 60.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.21 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.1 -48.07 82.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.695 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -63.2 -38.2 90.22 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.348 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -54.85 -36.65 65.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.462 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.01 -51.55 56.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.557 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 7.5 mmtm -62.64 -28.13 69.7 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.78 34.47 2.81 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.461 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.61 155.41 17.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.975 0.416 . . . . 0.0 110.85 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -83.46 94.34 7.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.824 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.574 ' HA ' HG22 ' A' ' 50' ' ' ILE . 80.1 p -79.96 155.2 27.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.971 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.653 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.9 139.95 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.699 -178.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.63 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -118.59 116.25 50.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.391 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.593 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 110.724 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.7 m-85 . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.763 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.14 150.59 27.02 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 111.541 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.824 ' HB ' HD23 ' A' ' 26' ' ' LEU . 98.3 t -124.36 102.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.633 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.6 tt0 -106.84 142.86 35.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.047 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.62 123.16 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.472 0.654 . . . . 0.0 111.488 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.522 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.22 105.52 0.23 Allowed Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.894 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.57 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.88 122.38 32.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.659 0.266 . . . . 0.0 110.397 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -140.74 171.62 13.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.203 0.525 . . . . 0.0 111.454 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -17.25 51.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.866 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.0 t -113.78 130.27 56.47 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.865 0.365 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 13.3 ttpt -57.13 -37.47 72.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.398 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.11 -31.16 3.25 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.966 0.412 . . . . 0.0 110.698 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CD1' ' A' ' 53' ' ' PHE . 19.8 m120 -73.28 -49.99 24.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.235 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.556 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.73 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.12 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.24 -51.15 71.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.844 0.355 . . . . 0.0 111.009 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 28.3 m -58.84 -35.21 72.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.918 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.032 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.33 -51.95 26.33 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.747 0.785 . . . . 0.0 110.187 179.435 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.744 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.99 -57.9 9.29 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.231 -1.35 . . . . 0.0 111.013 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.36 -37.39 62.35 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.429 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.4 ttt-85 -64.47 -38.23 90.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.639 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.27 -41.15 94.49 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.624 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.8 mttm -62.17 -46.94 86.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.691 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.29 -25.44 64.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.686 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.468 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.16 -22.54 52.37 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.36 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 23.59 5.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.584 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.563 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.36 148.93 52.72 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.447 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.5 74.74 5.16 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.807 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.47 141.83 29.65 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.062 0.458 . . . . 0.0 111.95 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.587 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -133.27 152.11 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.02 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.556 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.9 t -104.78 136.35 38.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.798 0.333 . . . . 0.0 111.085 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.587 HG23 HD12 ' A' ' 74' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.354 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.515 -0.377 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.513 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.6 m-85 -101.43 106.62 17.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.037 0.446 . . . . 0.0 109.997 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.49 155.45 38.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.429 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.001 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.78 142.92 18.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.284 179.876 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -133.91 132.74 40.62 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.581 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.07 -5.97 9.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.76 173.79 29.8 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 118.877 -1.63 . . . . 0.0 114.893 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' HG3' ' A' ' 47' ' ' LYS . . . -151.01 135.91 17.36 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.962 -0.619 . . . . 0.0 109.71 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.633 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.0 m-85 -145.01 149.37 35.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.8 0.334 . . . . 0.0 111.08 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -60.78 -14.13 19.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.937 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -106.76 127.99 61.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.062 0.458 . . . . 0.0 112.107 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -69.64 -42.27 74.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.579 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.11 -32.52 47.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.177 0.513 . . . . 0.0 109.815 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -76.94 -32.58 57.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.282 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.501 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.09 -20.63 60.2 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.891 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -39.13 20.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 110.747 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 t -66.61 -37.13 84.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 0.0 109.659 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.8 tp -66.47 -52.1 49.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.182 179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.654 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.03 -24.45 58.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.441 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.1 t -71.83 -41.74 67.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.556 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.88 -47.55 84.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.571 179.599 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.09 -41.41 92.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.648 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.15 -37.02 66.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.234 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.8 -51.12 64.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.341 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.43 -28.43 69.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.73 31.69 3.11 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.687 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.79 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -101.01 158.0 16.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 94.9 9.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.751 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.654 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 47.5 p -80.29 156.83 26.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.227 0.537 . . . . 0.0 110.982 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.63 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -155.97 137.13 5.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.659 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.501 HG13 ' HB1' ' A' ' 23' ' ' ALA . 39.3 t -113.98 112.67 41.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.607 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 CA-C-O 120.934 0.397 . . . . 0.0 110.614 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.45 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.8 m-85 . . . . . 0 C--O 1.225 -0.2 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.547 ' HG3' ' HB1' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.55 156.53 31.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.12 0.486 . . . . 0.0 111.613 -179.342 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.689 ' HB ' HD23 ' A' ' 26' ' ' LEU . 87.9 t -125.43 113.96 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.48 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.63 ' HB3' HG23 ' A' ' 38' ' ' ILE . 3.3 tt0 -111.93 141.32 45.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.1 123.44 39.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.515 0.674 . . . . 0.0 111.575 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.29 107.59 0.28 Allowed Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.823 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.495 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -129.37 118.37 22.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.688 0.28 . . . . 0.0 110.553 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.03 174.21 10.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.011 0.434 . . . . 0.0 111.551 -179.402 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.4 p -83.57 -17.04 43.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.093 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -112.55 128.34 56.33 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.85 0.357 . . . . 0.0 111.174 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.513 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.53 -34.74 64.96 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.082 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -52.23 -32.0 34.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.045 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.9 m120 -70.89 -49.6 44.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.617 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.46 -40.54 82.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.012 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -61.66 -49.98 74.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.761 0.315 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 1.1 m -59.48 -34.76 72.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.837 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.001 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.01 -51.52 24.95 Favored 'General case' 0 CA--C 1.503 -0.843 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.726 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.25 8.03 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.922 -177.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.67 -37.26 63.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.662 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 61' ' ' THR . 5.5 ttt180 -64.19 -38.73 92.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.777 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.79 -41.05 96.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.67 -46.38 89.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -69.79 -26.09 64.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.803 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.76 -22.85 53.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.404 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.25 23.59 5.42 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.466 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.566 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.72 148.8 52.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.4 t70 -92.34 73.53 5.29 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.675 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.43 142.79 28.99 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.116 0.484 . . . . 0.0 111.985 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.9 pt -134.69 162.01 39.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.617 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.0 t -112.29 137.03 46.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.323 -179.897 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -100.83 106.63 18.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.074 0.464 . . . . 0.0 110.069 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -126.31 156.77 39.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.52 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.045 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.92 138.99 31.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.316 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.145 179.761 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -131.22 133.75 45.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.717 0.294 . . . . 0.0 111.158 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.518 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.55 -5.64 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.41 175.21 29.08 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.055 -1.545 . . . . 0.0 114.558 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.623 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.62 142.54 23.0 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.995 -0.603 . . . . 0.0 109.426 178.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.611 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.8 m-85 -147.53 150.13 33.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.878 0.37 . . . . 0.0 111.346 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 29.3 pttt -61.72 -13.63 24.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.489 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.27 127.04 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.176 0.512 . . . . 0.0 111.959 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.09 -42.12 80.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.574 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.23 -31.69 63.77 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.148 0.499 . . . . 0.0 110.02 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -78.22 -34.94 49.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.5 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -19.21 61.04 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.881 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.95 -37.66 20.24 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.496 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -37.73 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 59.6 tp -66.26 -51.63 55.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.127 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -57.67 -23.87 53.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.534 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -41.15 64.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.63 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.08 -46.98 86.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.965 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.1 -40.41 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -55.28 -37.11 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.275 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.17 -50.81 66.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.376 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.3 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.07 32.3 3.08 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.537 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.78 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.1 m-85 -100.55 155.8 17.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.949 0.404 . . . . 0.0 110.858 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.44 92.41 8.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.697 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.632 ' HA ' HG22 ' A' ' 50' ' ' ILE . 96.4 p -80.12 157.4 26.65 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.175 0.512 . . . . 0.0 110.894 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.85 142.35 6.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.739 -178.431 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.621 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -121.8 122.41 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.272 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.424 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.457 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 25.8 m-85 . . . . . 0 C--O 1.231 0.08 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.76 147.03 27.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.917 0.389 . . . . 0.0 111.831 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.755 ' CB ' HD23 ' A' ' 26' ' ' LEU . 98.7 t -120.96 105.2 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.737 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 15.3 tt0 -111.86 142.04 44.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.416 -179.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.965 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.38 123.78 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-O 121.588 0.708 . . . . 0.0 111.561 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.402 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 81.08 106.32 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.872 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.11 117.45 20.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.666 0.269 . . . . 0.0 110.492 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -137.09 170.11 16.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.138 0.494 . . . . 0.0 111.422 -179.334 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -17.08 53.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.47 131.71 56.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.95 0.405 . . . . 0.0 110.947 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.498 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 5.0 ttpt -57.63 -37.96 74.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.376 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -46.04 -32.98 3.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.049 0.452 . . . . 0.0 110.854 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 13.2 m120 -71.91 -49.2 39.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.411 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.655 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.06 -44.57 87.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.084 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.29 -52.31 66.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.76 0.314 . . . . 0.0 111.209 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.47 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.04 -34.58 72.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.103 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.045 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.3 -51.9 26.86 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.718 0.77 . . . . 0.0 110.135 179.429 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.5 -59.13 5.11 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.029 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.72 -37.21 50.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.276 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.0 -38.25 90.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.784 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.34 -41.91 93.44 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.762 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.9 mttm -62.09 -46.83 87.35 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.638 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.58 -25.29 63.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.811 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.2 -23.3 51.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.336 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.64 23.36 5.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.412 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.18 149.18 52.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.2 t70 -92.98 74.59 4.78 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.662 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.5 143.41 28.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.135 0.493 . . . . 0.0 111.778 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.5 pt -134.69 151.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.837 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.655 HG22 ' HB1' ' A' ' 59' ' ' ALA . 88.1 t -103.61 135.78 39.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.26 -179.946 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 CA--C 1.516 -0.339 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.516 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.6 m-85 -101.86 106.79 17.81 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.142 0.496 . . . . 0.0 109.874 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 34.9 mttm -125.05 154.41 41.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.649 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -108.33 137.02 42.06 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.205 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -129.6 135.46 48.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.651 0.263 . . . . 0.0 111.008 -179.391 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.552 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.23 -5.03 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.64 173.52 28.22 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 118.964 -1.589 . . . . 0.0 114.559 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.612 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.87 143.49 23.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.861 -0.669 . . . . 0.0 109.29 178.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.9 m-85 -150.03 148.29 28.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.89 0.376 . . . . 0.0 111.393 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -60.8 -13.88 18.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.609 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.08 124.46 61.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.158 0.504 . . . . 0.0 112.116 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -64.93 -44.69 88.68 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.602 179.634 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.65 -31.77 48.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.15 0.5 . . . . 0.0 109.856 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.92 -35.77 50.17 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.593 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.05 -21.51 61.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -37.72 24.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -64.46 -37.18 86.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 109.626 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.977 HD12 ' OD1' ' A' ' 29' ' ' ASN . 26.8 tp -67.41 -50.8 57.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.331 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.579 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.37 -26.39 52.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.083 0.468 . . . . 0.0 110.652 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.34 -41.04 61.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.084 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.977 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.45 -48.92 79.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.962 0.41 . . . . 0.0 110.772 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.948 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.14 -39.32 89.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -54.36 -37.15 64.61 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.16 -50.54 64.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.429 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpp? -62.41 -28.37 69.74 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 33.83 2.82 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.501 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.2 m-85 -102.05 159.89 14.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.989 0.423 . . . . 0.0 110.626 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -87.56 94.06 9.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.602 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.42 157.91 26.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.007 0.432 . . . . 0.0 110.789 -178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.481 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.42 140.12 6.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.007 -178.463 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.59 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 30.1 t -118.99 118.79 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.002 0.429 . . . . 0.0 110.572 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.2 m-85 . . . . . 0 N--CA 1.46 0.057 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.612 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -102.72 146.5 28.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.229 0.537 . . . . 0.0 111.872 -178.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.4 t -121.79 103.4 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.621 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.1 tt0 -110.62 143.64 40.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.634 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.948 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.18 123.1 32.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.58 0.705 . . . . 0.0 111.618 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.66 111.78 0.3 Allowed Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.145 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.415 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.99 112.72 11.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.248 . . . . 0.0 110.371 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -129.65 173.77 10.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 0.0 111.522 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 m -83.81 -17.66 40.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.967 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.8 131.94 56.04 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.873 0.368 . . . . 0.0 111.078 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpp -58.06 -39.62 78.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.271 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -46.07 -32.52 2.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.96 0.409 . . . . 0.0 110.761 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 71.0 m-80 -70.98 -49.64 43.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.367 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.711 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.49 -41.02 75.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.04 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -61.45 -49.26 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.87 0.367 . . . . 0.0 110.902 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -60.92 -34.93 75.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.855 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.054 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.88 -53.05 16.55 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.877 0.846 . . . . 0.0 110.047 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.71 -58.83 5.99 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.141 -1.391 . . . . 0.0 110.853 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.86 -37.77 53.43 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.413 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.8 ttt180 -64.86 -39.41 93.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.752 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.03 -41.76 94.96 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.603 179.123 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 29.9 mttt -62.05 -47.14 86.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.695 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -69.14 -25.59 64.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.723 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.68 -22.22 54.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.271 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.85 23.74 5.78 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -129.99 148.58 51.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.392 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.7 t0 -92.06 73.85 5.53 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.926 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.01 140.57 30.93 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.05 0.452 . . . . 0.0 111.913 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 20.7 pt -133.34 152.11 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.922 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.711 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.6 t -103.17 138.18 28.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.898 0.38 . . . . 0.0 111.156 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 pt . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.351 -179.894 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 CA--C 1.515 -0.369 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.5 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -101.28 106.38 17.57 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.064 0.459 . . . . 0.0 109.971 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.12 154.3 41.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.458 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.059 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.58 140.5 24.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.19 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -133.37 135.29 44.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 111.243 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.561 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -108.06 -5.43 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.33 174.23 28.8 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 118.968 -1.587 . . . . 0.0 114.646 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.765 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.21 141.42 22.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.939 -0.631 . . . . 0.0 109.389 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.638 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.8 m-85 -147.27 149.54 33.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.973 0.416 . . . . 0.0 111.377 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.54 -12.83 16.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.09 125.93 63.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.078 0.466 . . . . 0.0 112.072 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 10.4 tmtt? -67.02 -42.02 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.414 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.63 -31.32 62.19 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.178 0.514 . . . . 0.0 109.909 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -78.36 -33.96 48.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.473 178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.07 -20.1 60.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -37.54 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -38.41 87.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.326 0.584 . . . . 0.0 109.512 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.815 HD12 ' ND2' ' A' ' 29' ' ' ASN . 41.8 tp -66.26 -51.49 57.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.21 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -57.93 -24.0 55.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.579 178.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t -72.92 -41.41 64.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.572 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.815 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.23 -47.03 86.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.568 179.834 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.97 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.58 -40.66 95.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.507 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -55.11 -37.26 66.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.312 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.28 67.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.171 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.36 -28.49 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.656 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.04 31.5 3.31 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.416 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.18 156.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.984 0.421 . . . . 0.0 110.777 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -85.68 93.33 8.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.728 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 81.7 p -80.43 157.6 26.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.23 0.538 . . . . 0.0 110.873 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.34 140.1 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.754 -178.543 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.15 116.31 51.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.272 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.592 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.332 -0.179 0 CA-C-O 120.844 0.354 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 26.9 m-85 . . . . . 0 CA--C 1.527 0.083 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.765 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.79 148.78 28.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.056 0.455 . . . . 0.0 111.733 -179.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.796 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.5 t -121.31 100.9 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.653 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -107.51 142.1 37.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.162 -179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.97 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.0 123.59 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-O 121.653 0.74 . . . . 0.0 111.658 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.407 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.92 105.58 0.26 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.701 -1.136 . . . . 0.0 113.002 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.61 112.68 14.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.754 0.311 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.28 171.69 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.066 0.46 . . . . 0.0 111.62 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -17.45 50.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.8 t -114.44 132.67 56.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.018 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.5 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.8 ttpp -58.24 -37.68 75.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.336 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -46.47 -32.13 3.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.109 0.48 . . . . 0.0 110.825 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.447 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 30.5 m120 -72.57 -49.58 31.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.35 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.688 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.46 -44.74 85.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.157 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -59.71 -50.35 74.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.826 0.346 . . . . 0.0 110.987 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.44 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.0 m -60.17 -35.23 74.88 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.806 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.059 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -52.01 27.54 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-O 121.811 0.815 . . . . 0.0 109.989 179.493 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -58.72 6.38 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.179 -1.373 . . . . 0.0 111.066 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.27 -36.42 52.7 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.385 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt180 -65.82 -39.17 90.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.702 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.99 -41.16 97.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.574 178.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 36.8 mttm -61.88 -46.07 91.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.751 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -70.16 -25.48 63.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.806 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.482 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.07 -23.11 52.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.239 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.15 24.0 5.29 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.407 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.31 147.82 52.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 13.0 t70 -92.31 74.44 5.32 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.689 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.89 142.71 29.51 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.105 0.479 . . . . 0.0 111.908 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -133.94 153.04 35.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.855 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.688 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.0 t -102.83 136.06 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.955 0.407 . . . . 0.0 111.123 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt . . . . . 0 C--O 1.234 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.106 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.515 -0.396 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.8 m-85 -101.33 106.66 17.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 110.097 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -124.84 154.06 41.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.462 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.047 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.57 139.73 27.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.33 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -131.79 133.09 44.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.733 0.301 . . . . 0.0 111.058 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.58 -5.46 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -179.048 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.57 175.45 28.51 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 119.123 -1.513 . . . . 0.0 114.553 178.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.741 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.81 145.36 24.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.946 -0.627 . . . . 0.0 109.342 178.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.577 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.4 m-85 -149.11 153.1 37.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.123 0.487 . . . . 0.0 111.531 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -61.42 -16.78 50.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.255 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -106.93 129.25 60.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 112.182 -179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.6 OUTLIER -70.57 -39.89 73.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.316 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.03 -32.84 66.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 0.0 109.9 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -76.58 -34.66 58.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.254 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.65 -18.47 61.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.826 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -37.7 21.01 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.513 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.6 t -66.02 -38.04 87.43 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 57.3 tp -65.6 -51.34 60.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.058 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.635 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.04 -23.91 56.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.493 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.0 t -72.8 -41.25 65.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.545 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.55 -47.97 83.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.541 179.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.55 -41.22 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.605 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.91 -37.43 66.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.36 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.06 69.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.359 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 12.6 mmtt -62.29 -28.28 69.61 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.72 31.33 3.21 Favored Glycine 0 N--CA 1.442 -0.918 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.608 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.764 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -101.6 158.81 15.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.915 0.388 . . . . 0.0 110.853 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.92 93.94 9.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.816 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.635 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 57.6 p -80.4 157.94 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.997 0.427 . . . . 0.0 110.813 -178.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.531 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -158.48 140.7 5.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.92 -178.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.37 117.46 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.07 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.333 -0.137 0 CA-C-O 120.996 0.427 . . . . 0.0 110.647 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 30.5 m-85 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.741 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.04 147.66 29.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.172 0.51 . . . . 0.0 111.955 -179.159 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.737 ' CB ' HD23 ' A' ' 26' ' ' LEU . 94.9 t -120.29 104.19 15.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.531 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.3 tt0 -109.6 141.26 42.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.359 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.3 123.7 39.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.602 0.715 . . . . 0.0 111.597 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.48 108.97 0.29 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.925 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.71 112.87 13.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.728 0.299 . . . . 0.0 110.377 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.16 170.38 14.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 111.432 -179.285 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 t -79.64 -18.27 51.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.027 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -115.33 137.87 51.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.92 0.39 . . . . 0.0 111.109 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -61.49 -38.9 88.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.634 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -45.83 -31.77 2.25 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.962 0.411 . . . . 0.0 111.016 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 62.7 m-80 -73.14 -49.06 30.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.694 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.12 -43.3 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.991 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -60.91 -49.35 77.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.811 0.338 . . . . 0.0 110.938 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.1 m -61.17 -33.86 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.047 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.52 -52.49 18.02 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 121.739 0.78 . . . . 0.0 109.934 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.763 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.98 -57.86 9.96 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.787 -178.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.17 -37.72 55.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.41 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.1 ttt85 -65.21 -37.94 88.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.821 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.52 -42.83 91.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.611 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.3 mmmm -61.34 -46.56 89.74 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.854 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -70.24 -25.41 63.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.738 178.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.442 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.77 -22.96 53.0 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.56 23.43 5.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.483 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.584 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.87 148.12 52.6 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 32.4 t70 -91.89 75.04 5.65 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.565 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.63 141.69 29.61 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.846 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.584 HD12 HG23 ' A' ' 76' ' ' ILE . 1.2 pp -133.27 153.04 36.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.911 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.694 HG22 ' HB1' ' A' ' 59' ' ' ALA . 76.9 t -104.86 137.18 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.031 0.443 . . . . 0.0 111.14 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.584 HG23 HD12 ' A' ' 74' ' ' ILE . 6.7 pt . . . . . 0 C--O 1.236 0.367 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.208 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.516 -0.351 0 CA-C-O 120.742 0.306 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.8 m-85 -102.32 106.48 17.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.114 0.483 . . . . 0.0 109.968 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 42.6 mttt -124.51 154.78 40.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.467 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.68 145.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.309 179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tm0? -137.78 134.01 34.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -178.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.564 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.2 -5.41 10.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.77 169.47 27.31 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 119.256 -1.45 . . . . 0.0 114.623 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.74 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.93 140.75 21.85 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.508 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.7 m-85 -151.38 150.08 30.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -13.81 17.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.478 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.05 128.9 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-O 120.897 0.38 . . . . 0.0 111.794 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -71.8 -40.97 68.83 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.682 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.92 -29.51 20.46 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.232 0.539 . . . . 0.0 109.725 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -81.82 -31.88 31.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.726 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.76 -23.08 58.48 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.03 179.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -83.02 -40.36 20.04 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.624 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -37.29 86.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.211 0.529 . . . . 0.0 109.775 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.919 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.2 tp -68.21 -47.53 67.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.279 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.58 -25.85 63.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.046 0.45 . . . . 0.0 110.503 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -74.75 -41.08 60.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.045 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.919 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.05 -48.71 80.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.813 0.34 . . . . 0.0 110.627 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.88 -38.18 89.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.382 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -54.63 -36.88 64.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.398 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.99 -50.17 64.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.434 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.32 -28.0 69.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.27 32.25 3.53 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.188 -0.914 . . . . 0.0 112.383 179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.796 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -99.18 154.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.973 0.416 . . . . 0.0 110.724 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -81.54 92.51 6.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.004 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.596 ' HA ' HG22 ' A' ' 50' ' ' ILE . 93.5 p -79.69 155.25 28.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.123 0.487 . . . . 0.0 110.927 -178.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.635 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.39 140.92 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.822 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 42.3 t -118.59 118.17 57.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.118 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.577 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.103 0 CA-C-O 121.065 0.46 . . . . 0.0 110.561 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 30.6 m-85 . . . . . 0 C--O 1.231 0.119 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -109.22 151.18 26.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.161 0.505 . . . . 0.0 111.784 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.727 ' HB ' HD23 ' A' ' 26' ' ' LEU . 86.5 t -123.9 102.19 10.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.565 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.635 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -106.7 141.98 37.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.89 -179.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 123.1 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.61 0.719 . . . . 0.0 111.246 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.45 104.63 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.849 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.535 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -125.73 124.02 40.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.646 0.26 . . . . 0.0 110.666 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.04 174.36 10.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.036 0.446 . . . . 0.0 111.404 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -83.49 -16.7 44.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.74 130.59 56.41 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.977 0.418 . . . . 0.0 111.172 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.493 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.69 -34.66 67.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.164 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -52.34 -32.57 38.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 0.0 111.07 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.683 ' O ' HG22 ' A' ' 61' ' ' THR . 2.6 m120 -70.26 -48.45 56.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.693 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.614 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.24 -39.98 92.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.841 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -60.16 -51.78 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.683 HG22 ' O ' ' A' ' 58' ' ' ASN . 15.4 t -58.91 -34.75 72.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 0.0 110.855 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.4 -50.96 33.15 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.741 0.781 . . . . 0.0 110.049 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.0 -58.19 7.8 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.044 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.6 -35.46 65.84 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.65 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -63.96 -40.9 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 179.083 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.35 -40.07 95.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.451 178.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.0 mmmm -61.71 -47.24 86.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.719 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -26.34 65.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.809 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.51 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.67 -21.93 54.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.587 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.66 23.21 5.74 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.385 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.609 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.58 148.97 52.44 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 8.3 t0 -92.08 74.72 5.51 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.807 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.8 143.16 27.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.911 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -136.46 162.95 34.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.7 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.614 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.7 t -111.58 136.77 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.959 0.409 . . . . 0.0 111.013 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.12 -179.829 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mp . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.503 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -100.9 107.28 18.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.146 0.498 . . . . 0.0 110.018 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -127.2 155.74 42.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.596 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.1 137.58 38.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.2 179.829 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -130.36 133.3 46.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.336 . . . . 0.0 111.024 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.546 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -104.8 -4.79 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.67 174.73 28.76 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 119.05 -1.548 . . . . 0.0 114.674 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.759 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.34 140.37 21.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.548 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -144.75 148.84 34.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.834 0.35 . . . . 0.0 111.401 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -61.06 -14.42 23.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.448 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.2 t -107.17 128.94 61.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.092 0.472 . . . . 0.0 111.92 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.4 OUTLIER -68.72 -42.74 77.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.579 179.655 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.87 -32.04 60.33 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 109.852 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -77.45 -35.16 54.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.315 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.31 -18.97 61.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.771 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.81 -37.62 20.55 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.488 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.4 t -65.03 -37.0 86.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.98 HD12 ' OD1' ' A' ' 29' ' ' ASN . 33.7 tp -68.49 -50.41 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.198 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.45 -26.07 52.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -40.49 60.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.146 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.98 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.65 -48.71 80.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.919 0.39 . . . . 0.0 110.665 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.72 -39.06 90.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.359 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -54.67 -37.13 65.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.336 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.11 -49.59 68.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.425 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.0 mmtt -62.28 -28.3 69.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.29 32.88 3.09 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.473 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -101.82 159.08 15.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.983 0.421 . . . . 0.0 110.682 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -87.04 94.69 9.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.879 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.585 ' HA ' HG22 ' A' ' 50' ' ' ILE . 87.4 p -80.38 157.04 26.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.09 0.472 . . . . 0.0 110.818 -178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.91 141.69 6.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.771 -178.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.615 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 20.6 t -119.69 117.93 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.494 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.578 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.113 0 CA-C-O 120.874 0.369 . . . . 0.0 110.77 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.461 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.1 m-85 . . . . . 0 N--CA 1.461 0.078 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.759 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.08 147.79 27.51 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.17 0.509 . . . . 0.0 112.022 -179.473 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 93.7 t -120.67 101.64 11.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.362 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 11.3 tt0 -109.02 142.25 39.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.595 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.14 123.38 39.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.539 0.685 . . . . 0.0 111.5 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.24 105.64 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 114.827 -1.078 . . . . 0.0 113.054 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.57 116.36 19.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.778 0.323 . . . . 0.0 110.232 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.58 173.53 11.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.027 0.441 . . . . 0.0 111.604 -179.158 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.42 -17.85 40.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.07 131.92 56.21 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.888 0.375 . . . . 0.0 111.078 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.503 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -58.66 -38.96 79.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.397 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -44.98 -33.89 2.21 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.963 0.411 . . . . 0.0 110.782 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 26.8 m-80 -72.47 -48.78 38.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.331 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.574 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.69 -45.23 85.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.001 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.33 -50.65 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.864 0.364 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 5.2 m -58.58 -36.18 73.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.61 34.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 121.709 0.766 . . . . 0.0 110.065 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.93 -59.54 4.59 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.026 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.96 -37.89 47.27 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.567 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.4 ttt180 -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.983 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.96 -42.93 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.776 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.46 -47.13 87.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.658 178.83 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -25.86 64.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.74 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.476 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.94 53.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.315 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.33 23.18 5.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.515 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.572 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.21 148.94 52.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.462 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.0 t70 -92.93 74.44 4.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.07 142.06 28.98 Favored 'General case' 0 CA--C 1.524 -0.029 0 CA-C-O 121.108 0.48 . . . . 0.0 111.751 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -133.4 149.91 31.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.03 179.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.574 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.6 t -102.72 136.27 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.895 0.379 . . . . 0.0 111.078 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.25 -179.973 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 9' ' ' LEU . 3.1 mm? . . . . . 0 CA--C 1.515 -0.386 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 45.7 m-85 -101.62 106.35 17.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.058 0.456 . . . . 0.0 109.98 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 10.2 mttt -125.68 153.18 44.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.689 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.88 136.65 39.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.164 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -129.69 134.78 47.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.808 0.337 . . . . 0.0 111.163 -179.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.521 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.07 -6.16 10.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -178.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.44 173.06 29.61 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 118.792 -1.671 . . . . 0.0 114.944 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.17 137.52 18.52 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.467 178.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.9 m-85 -146.2 149.35 33.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.784 0.326 . . . . 0.0 111.058 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -59.69 -14.66 15.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.828 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.51 130.29 60.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.096 0.474 . . . . 0.0 112.049 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -72.23 -40.6 67.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.623 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.62 -34.18 57.62 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.303 0.573 . . . . 0.0 109.791 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -75.32 -32.67 61.02 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.212 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.39 -20.2 60.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.034 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -83.34 -38.48 22.0 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.681 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.86 -38.23 85.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.315 0.579 . . . . 0.0 109.646 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 48.6 tp -65.31 -51.1 62.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.149 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.539 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.98 -24.85 63.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.574 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.377 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.3 -46.93 87.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.426 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.36 -42.65 87.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.622 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -55.34 -37.28 67.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.311 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -52.54 -51.54 59.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.296 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 3.5 mmpt? -63.2 -28.97 70.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.21 33.28 2.79 Favored Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.528 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.95 160.14 14.75 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.925 0.393 . . . . 0.0 110.81 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -88.96 94.68 10.03 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.773 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -80.6 157.55 25.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.146 0.498 . . . . 0.0 110.861 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.7 140.16 5.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.724 -178.699 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 23' ' ' ALA . 21.4 t -115.11 112.51 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.282 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.631 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.239 0 CA-C-O 120.998 0.428 . . . . 0.0 110.714 179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.432 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 23.8 m-85 . . . . . 0 C--O 1.226 -0.179 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.27 155.51 29.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.967 0.413 . . . . 0.0 111.455 -179.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' A' ' 26' ' ' LEU . 59.3 t -125.21 109.91 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.959 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.48 ' HB3' HG23 ' A' ' 38' ' ' ILE . 32.9 tt0 -110.09 142.05 42.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.034 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.82 122.76 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 121.601 0.715 . . . . 0.0 111.525 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.0 105.0 0.32 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.826 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -128.41 113.31 15.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.696 0.284 . . . . 0.0 110.429 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -132.15 173.4 11.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.23 0.538 . . . . 0.0 111.389 -179.274 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -16.27 46.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.106 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.93 129.44 56.47 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.892 0.377 . . . . 0.0 111.094 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.4 OUTLIER -56.1 -35.36 66.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.25 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.9 -32.2 31.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.451 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 11.3 m120 -70.34 -49.83 45.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.558 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.3 -41.25 88.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.011 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -60.22 -50.86 72.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.7 0.285 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.8 m -59.0 -36.9 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.83 -51.43 40.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 121.834 0.826 . . . . 0.0 110.17 179.375 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.61 -60.3 3.53 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.211 -1.358 . . . . 0.0 111.124 -177.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -36.97 40.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.462 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -65.41 -39.3 91.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.835 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.7 -41.92 95.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.662 179.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.4 mttt -61.59 -46.65 88.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.698 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -69.74 -25.52 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.691 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.96 -22.72 52.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.402 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 24.14 5.42 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.545 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.52 148.29 52.3 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.02 72.48 5.55 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.852 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.81 141.39 30.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.1 0.476 . . . . 0.0 111.722 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 6.9 pt -133.61 152.22 34.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.007 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.602 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.9 t -103.39 136.2 37.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.867 0.365 . . . . 0.0 111.039 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.34 -179.731 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 15.2 mt . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -101.83 106.72 17.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -124.8 155.65 39.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.47 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.992 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.59 141.61 23.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.435 179.627 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.441 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 17.7 tt0 -134.47 134.43 41.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.729 0.3 . . . . 0.0 111.319 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.651 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.71 -5.11 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.14 172.08 27.99 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 119.071 -1.538 . . . . 0.0 114.82 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.814 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.29 145.51 25.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 178.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.493 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.1 m-85 -151.63 151.62 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.004 0.431 . . . . 0.0 111.33 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -60.45 -15.46 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.422 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.7 t -106.38 128.39 60.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.001 0.429 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.24 -40.46 74.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.3 -33.08 62.96 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.267 0.556 . . . . 0.0 109.739 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -75.97 -33.83 59.77 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.264 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.91 -22.75 61.44 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.775 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.71 -37.21 31.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.596 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -38.58 89.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.215 0.531 . . . . 0.0 109.758 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.929 HD12 ' OD1' ' A' ' 29' ' ' ASN . 15.2 tp -66.93 -47.28 72.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.23 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.782 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -60.27 -25.61 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 110.578 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -40.52 57.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.018 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.929 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -60.25 -48.4 81.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.339 . . . . 0.0 110.626 -179.924 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.5 -38.76 91.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.255 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -54.96 -36.58 65.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.278 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.62 73.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.229 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.3 -28.17 69.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 31.14 3.55 Favored Glycine 0 N--CA 1.442 -0.936 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.497 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -100.37 156.92 16.98 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.794 0.331 . . . . 0.0 110.711 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.83 95.41 9.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.999 179.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.782 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 19.1 p -80.24 155.85 27.14 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.201 0.524 . . . . 0.0 111.044 -178.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.657 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -155.47 139.88 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.548 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.8 t -117.87 116.3 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.543 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.615 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.333 -0.142 0 CA-C-O 120.864 0.364 . . . . 0.0 110.458 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 22.7 m-85 . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.769 0.319 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.32 149.4 28.7 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.107 0.48 . . . . 0.0 111.268 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.641 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.7 t -122.04 100.45 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.609 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.68 ' NE2' ' HB2' ' A' ' 52' ' ' ALA . 4.5 tt0 -104.75 142.01 35.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.78 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.03 122.76 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.438 0.637 . . . . 0.0 111.425 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.475 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 82.01 107.38 0.4 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.78 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.68 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.7 121.06 29.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.258 . . . . 0.0 110.584 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -141.19 172.31 12.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.111 0.481 . . . . 0.0 111.424 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -83.99 -16.22 44.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.221 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 m -111.63 127.49 55.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.84 0.352 . . . . 0.0 111.198 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -54.82 -36.49 65.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -52.97 -30.03 32.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.423 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -71.81 -49.61 37.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.639 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.471 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.41 -40.87 95.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.937 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.24 -50.7 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 m -58.38 -36.57 73.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.674 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.992 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -69.24 -50.04 50.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.746 0.784 . . . . 0.0 110.065 179.355 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.7 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.76 -59.22 4.9 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.284 -1.325 . . . . 0.0 111.135 -177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.49 -36.1 63.8 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.792 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -40.82 97.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.961 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.81 -39.22 93.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.495 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.8 mttm -62.66 -46.66 87.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.569 178.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -26.23 64.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.734 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.483 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.59 -22.26 54.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.508 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.7 23.15 5.75 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.592 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.33 148.56 52.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 10.0 t70 -91.93 74.63 5.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.752 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.86 142.0 29.2 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.151 0.5 . . . . 0.0 112.117 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -134.07 160.98 41.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.748 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.482 HG22 HG13 ' A' ' 12' ' ' VAL . 98.5 t -113.1 137.58 45.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.904 0.383 . . . . 0.0 111.072 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.2 pt . . . . . 0 C--O 1.236 0.392 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.454 -179.942 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 9' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.519 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 41.9 m-85 -102.35 106.08 16.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.119 0.485 . . . . 0.0 110.172 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.422 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 12.4 mttm -125.14 153.46 42.98 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.474 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.97 139.99 26.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.342 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -134.33 134.35 41.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.617 0.246 . . . . 0.0 111.236 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.4 -4.8 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.128 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.58 175.87 29.0 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 118.993 -1.575 . . . . 0.0 114.757 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.813 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.78 148.47 27.9 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.588 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.4 m-85 -152.76 151.88 31.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.959 0.409 . . . . 0.0 111.441 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.65 -14.82 22.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.421 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.46 127.76 64.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.143 0.497 . . . . 0.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.86 -38.21 73.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.344 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -33.57 67.94 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.172 0.511 . . . . 0.0 109.658 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -75.62 -33.5 60.51 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.115 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.74 -18.54 60.97 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.798 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.55 -36.96 21.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.478 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -38.05 84.19 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.81 HD12 ' ND2' ' A' ' 29' ' ' ASN . 49.0 tp -66.22 -51.6 56.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.105 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.67 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.23 -24.37 59.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.306 178.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -41.04 67.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.587 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.81 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.53 -46.95 87.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.45 179.66 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.45 -41.18 93.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.45 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -55.05 -36.86 66.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.55 -51.44 62.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.303 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.0 mmpt? -62.6 -28.61 70.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.55 32.83 2.83 Favored Glycine 0 N--CA 1.443 -0.854 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.585 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.9 m-85 -101.2 158.51 15.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.698 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -87.38 94.93 9.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.923 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.67 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 21.7 p -80.56 157.01 26.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.15 0.5 . . . . 0.0 110.972 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.552 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.59 141.08 6.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.643 -178.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.88 116.56 52.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.51 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.623 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.434 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 25.6 m-85 . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.83 146.81 31.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.065 0.459 . . . . 0.0 111.248 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.716 ' HB ' HD23 ' A' ' 26' ' ' LEU . 72.8 t -117.74 100.33 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.58 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.552 ' HB3' HG23 ' A' ' 38' ' ' ILE . 37.6 tt0 -104.89 140.37 38.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.136 -179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.34 123.07 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.562 0.696 . . . . 0.0 111.57 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.71 106.99 0.25 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 114.739 -1.119 . . . . 0.0 112.879 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.422 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -130.13 115.58 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 110.484 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -134.27 173.5 11.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.227 0.537 . . . . 0.0 111.495 -179.252 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.52 -16.35 45.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.157 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.02 129.2 56.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.829 0.347 . . . . 0.0 111.081 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.519 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.9 OUTLIER -56.25 -35.15 67.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.221 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -52.44 -30.8 31.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.449 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 27.9 m120 -71.86 -49.92 33.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.71 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.513 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.86 -41.24 91.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.28 -51.01 71.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.998 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.69 -34.81 73.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.94 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.32 -51.6 28.96 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.804 0.811 . . . . 0.0 109.892 179.425 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.762 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.49 -58.91 5.63 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.932 -178.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.32 -37.28 55.44 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.476 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -64.69 -38.93 92.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.823 178.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.13 96.3 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.553 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 48.0 mttm -61.85 -46.8 87.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.654 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.66 -25.68 64.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.818 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.483 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.79 -22.41 53.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.278 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.34 24.18 5.47 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.421 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.74 147.98 52.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 23.0 t70 -91.58 73.42 5.93 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.607 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -83.99 140.92 31.58 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.16 0.505 . . . . 0.0 111.859 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.646 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -132.07 150.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.88 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.513 HG22 ' HB1' ' A' ' 59' ' ' ALA . 89.6 t -104.12 134.83 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.848 0.356 . . . . 0.0 110.966 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.646 HG23 HD12 ' A' ' 74' ' ' ILE . 1.3 pt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.127 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 CA--C 1.514 -0.419 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.517 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.2 m-85 -101.76 106.53 17.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.177 0.513 . . . . 0.0 110.127 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -126.15 153.24 44.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.344 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.018 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.21 138.44 31.63 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.145 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.439 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 16.1 tt0 -132.12 133.38 44.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.717 0.294 . . . . 0.0 111.127 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.635 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -107.34 -4.97 10.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.275 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.56 171.04 28.24 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 119.152 -1.499 . . . . 0.0 115.034 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.873 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 144.46 24.89 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 178.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.454 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -152.84 151.05 29.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.534 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.46 -15.33 16.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.598 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.63 128.35 61.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.95 0.405 . . . . 0.0 111.8 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.47 -39.1 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.45 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -32.69 63.56 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -76.34 -32.89 58.92 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.183 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.648 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.99 -23.6 61.44 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.722 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -37.46 30.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.717 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -65.48 -38.9 91.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.237 0.541 . . . . 0.0 109.877 179.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.932 HD12 ' OD1' ' A' ' 29' ' ' ASN . 14.7 tp -66.99 -45.91 76.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.232 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -61.13 -26.25 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.058 0.456 . . . . 0.0 110.537 179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.69 -40.87 61.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.041 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.932 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.6 -48.43 81.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.758 0.313 . . . . 0.0 110.642 179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.957 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.25 -38.26 88.57 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.282 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -54.9 -37.02 65.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.232 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.72 67.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.423 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.35 -28.28 69.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.42 33.37 3.16 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.438 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -100.75 156.28 17.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.94 0.4 . . . . 0.0 110.779 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.02 94.51 8.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.84 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.557 ' HA ' HG22 ' A' ' 50' ' ' ILE . 91.9 p -80.23 155.51 27.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.206 0.527 . . . . 0.0 111.126 -178.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.645 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.62 137.7 7.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.717 -178.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.648 HG13 ' HB1' ' A' ' 23' ' ' ALA . 22.0 t -117.6 115.69 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.38 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.566 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.334 -0.091 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.462 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.5 m-85 . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.873 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.82 149.62 28.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.186 0.517 . . . . 0.0 111.412 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.573 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.6 t -122.54 99.37 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.445 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.645 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -104.66 142.22 35.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.984 -179.282 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.957 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 122.59 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 111.396 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.559 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.96 104.81 0.26 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 114.818 -1.083 . . . . 0.0 112.867 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.644 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -127.24 125.4 40.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -144.25 173.67 11.56 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.135 0.493 . . . . 0.0 111.574 -179.337 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 97.1 p -83.47 -16.59 45.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.062 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.42 129.74 56.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.886 0.374 . . . . 0.0 111.078 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.9 -34.85 68.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.237 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -51.52 -31.9 25.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.883 0.373 . . . . 0.0 111.134 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.464 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 73.3 m-80 -71.68 -49.57 38.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.697 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.502 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.45 -43.32 96.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.44 -51.44 69.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.931 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 70.6 m -57.88 -37.15 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.878 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.018 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.77 -51.12 44.45 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.714 0.768 . . . . 0.0 110.304 179.555 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.74 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.02 -59.67 4.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.099 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.73 -36.6 57.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.507 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.26 -39.6 94.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.765 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.64 -40.46 95.49 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.533 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.7 mttm -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.588 178.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -68.58 -25.94 65.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.846 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.502 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.97 -22.26 53.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.5 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 23.13 5.88 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.418 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.564 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.34 148.96 52.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.379 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.475 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.6 t70 -92.63 74.67 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.958 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.37 140.67 30.58 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.105 0.478 . . . . 0.0 111.907 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 11.3 pt -132.89 150.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.969 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.502 HG22 ' HB1' ' A' ' 59' ' ' ALA . 99.3 t -103.91 136.83 35.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.077 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 C--O 1.236 0.374 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.347 -179.836 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.4 m-85 -101.5 106.62 17.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.088 0.47 . . . . 0.0 109.896 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -125.54 152.46 45.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.451 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.037 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.59 136.65 38.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.283 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -128.06 135.48 49.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.598 0.237 . . . . 0.0 111.111 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.668 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.32 -6.14 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.61 173.08 29.82 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 118.795 -1.669 . . . . 0.0 115.374 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.34 142.68 23.38 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 114.62 -0.79 . . . . 0.0 108.949 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.33 150.38 28.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.949 0.405 . . . . 0.0 111.331 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -59.89 -15.38 21.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.617 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -107.88 127.27 64.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.005 0.431 . . . . 0.0 111.826 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.33 -38.26 68.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.658 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.29 -34.92 61.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.249 0.547 . . . . 0.0 109.591 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -73.98 -32.37 63.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.124 178.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.443 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.78 -19.99 60.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.978 179.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -82.12 -38.72 24.35 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.733 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -36.75 79.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.245 0.545 . . . . 0.0 109.799 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.84 HD12 ' ND2' ' A' ' 29' ' ' ASN . 51.0 tp -65.52 -51.95 56.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.472 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.11 -28.48 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -41.7 85.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.617 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.84 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.8 -47.92 83.78 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.692 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.76 -42.1 88.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.673 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.9 -37.17 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.395 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.23 -51.11 63.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.344 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.521 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpt? -62.61 -28.76 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.3 32.78 2.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.488 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.723 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -102.11 159.82 15.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.959 0.409 . . . . 0.0 110.716 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -88.33 94.88 9.98 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.907 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.586 ' HA ' HG22 ' A' ' 50' ' ' ILE . 78.2 p -80.69 156.62 26.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.155 0.503 . . . . 0.0 110.91 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.92 135.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -112.06 112.04 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.111 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.857 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' CE2' ' HG3' ' A' ' 20' ' ' LYS . 26.2 m-85 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -119.08 156.52 29.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.986 0.422 . . . . 0.0 110.806 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.668 HG12 HD11 ' A' ' 14' ' ' ILE . 58.7 t -124.62 109.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.357 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' HG23 ' A' ' 38' ' ' ILE . 35.3 tt0 -107.41 140.99 39.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.473 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.71 122.95 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.536 0.684 . . . . 0.0 111.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.58 104.96 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.871 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.95 112.65 14.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -130.39 171.05 13.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.078 0.466 . . . . 0.0 111.472 -179.188 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 t -80.83 -17.75 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.032 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -113.16 130.92 56.05 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.81 0.338 . . . . 0.0 111.053 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.9 ttpt -57.08 -38.85 73.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.72 -31.38 2.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.099 0.476 . . . . 0.0 110.776 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 33.4 m120 -72.21 -49.76 32.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.319 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.726 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.87 -43.32 81.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.118 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.29 -49.61 76.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.861 0.362 . . . . 0.0 110.843 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.7 m -60.18 -35.43 75.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.037 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.29 -52.87 19.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.874 0.845 . . . . 0.0 110.147 179.371 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.761 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.48 -58.92 5.57 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.899 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.63 -37.76 51.68 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt-85 -65.29 -37.97 88.8 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.798 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.42 -42.5 92.42 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.783 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 18.6 mttm -61.54 -46.51 89.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.696 178.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.78 -25.34 63.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.658 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.478 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.39 -23.17 50.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.283 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.05 23.97 5.33 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.524 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.529 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.04 148.76 52.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 12.8 t70 -92.24 73.48 5.38 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.1 140.42 30.24 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.079 0.466 . . . . 0.0 111.681 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.51 HD12 HG23 ' A' ' 76' ' ' ILE . 1.0 OUTLIER -132.87 152.35 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.003 179.211 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.726 HG22 ' HB1' ' A' ' 59' ' ' ALA . 86.7 t -101.65 138.04 27.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.943 0.401 . . . . 0.0 111.051 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.51 HG23 HD12 ' A' ' 74' ' ' ILE . 7.0 pt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.252 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt . . . . . 0 CA--C 1.517 -0.323 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -101.39 106.29 17.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.016 0.436 . . . . 0.0 110.209 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.33 154.37 43.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.607 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.31 140.03 25.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.277 179.821 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.657 ' HB3' HD11 ' A' ' 74' ' ' ILE . 4.4 tt0 -132.09 136.95 47.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.743 0.306 . . . . 0.0 111.145 -179.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.51 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.97 -6.28 11.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -179.037 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.78 172.71 29.52 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.892 -1.623 . . . . 0.0 115.021 178.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.97 134.34 16.2 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 114.856 -0.672 . . . . 0.0 109.474 178.406 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.634 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -143.34 149.0 37.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -12.0 12.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.894 -179.925 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.55 129.06 63.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.951 0.405 . . . . 0.0 112.033 -179.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.4 ttpt -70.31 -41.53 73.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.684 179.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.38 -33.71 54.82 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.217 0.532 . . . . 0.0 109.803 179.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -76.48 -32.29 58.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.321 178.459 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.68 -21.18 60.34 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.98 179.416 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -83.68 -38.03 22.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.2 t -67.07 -37.21 83.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.187 0.518 . . . . 0.0 109.648 179.061 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 44.3 tp -66.98 -51.89 49.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.3 -24.3 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -72.44 -41.36 66.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.635 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.27 -46.93 87.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.532 179.696 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.54 -40.66 95.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -36.91 66.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.38 179.73 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.7 -51.42 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.31 179.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.63 -28.52 69.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.692 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.28 32.71 2.92 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.65 179.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.8 m-85 -100.71 156.48 17.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.56 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -85.3 94.54 8.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.655 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 29.5 p -80.03 155.54 27.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.919 -178.664 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.35 135.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.741 -178.587 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 23' ' ' ALA . 40.2 t -112.91 111.01 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.127 179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.627 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 121.013 0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 24.0 m-85 . . . . . 0 C--O 1.227 -0.118 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -117.14 155.39 29.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 111.409 -179.547 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.75 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.2 t -126.46 108.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.358 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 38' ' ' ILE . 4.7 tt0 -109.77 143.26 39.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.696 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.42 123.54 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.521 0.677 . . . . 0.0 111.746 179.799 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.472 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.77 104.18 0.26 Allowed Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.968 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.6 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -126.73 120.58 29.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.676 0.274 . . . . 0.0 110.32 179.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -139.17 171.36 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.033 0.444 . . . . 0.0 111.581 -179.114 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -80.97 -17.34 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.962 179.53 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.01 131.58 56.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.025 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.2 ttpt -57.8 -37.63 74.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -46.18 -32.77 3.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.041 0.448 . . . . 0.0 110.988 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.454 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 45.9 m-80 -71.83 -49.61 36.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.736 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.6 -44.18 85.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.206 179.581 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.79 -51.92 67.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.757 0.313 . . . . 0.0 111.192 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.59 -34.11 72.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.059 -179.871 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.92 -53.2 15.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.83 0.824 . . . . 0.0 110.138 179.561 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.752 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.75 -58.56 6.79 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.911 -178.041 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.37 -37.67 56.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.396 179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.0 ttt180 -64.64 -37.65 88.29 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.788 178.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.62 -42.29 91.71 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.721 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 20.7 mttt -61.53 -46.61 89.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.682 178.71 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -69.88 -25.32 63.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.459 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.6 -23.25 49.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.217 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.38 24.25 5.13 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.53 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.87 148.84 52.57 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.302 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 22.5 t0 -92.63 74.28 5.06 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.727 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 142.1 28.1 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.183 0.516 . . . . 0.0 111.705 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.768 ' O ' HD12 ' A' ' 74' ' ' ILE . 2.2 pp -134.72 153.57 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.801 178.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.736 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.6 t -101.12 136.53 32.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.946 0.403 . . . . 0.0 111.041 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.2 pt . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.39 -179.902 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 CA--C 1.514 -0.424 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.31 106.85 18.08 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.105 0.479 . . . . 0.0 110.085 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.7 mttp -126.78 154.18 44.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.446 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.025 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -109.28 135.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.141 179.701 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -127.68 138.14 52.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.542 0.21 . . . . 0.0 111.07 -179.356 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.612 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -108.16 -4.59 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.923 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.38 176.27 30.24 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 118.609 -1.758 . . . . 0.0 115.352 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.62 143.94 24.07 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.596 -0.802 . . . . 0.0 108.999 178.024 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.483 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.1 m-85 -152.95 144.07 23.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.954 0.407 . . . . 0.0 111.635 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -17.29 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.187 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.28 127.57 62.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.284 0.564 . . . . 0.0 112.175 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tmtt? -70.16 -41.78 73.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.634 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.03 -35.51 47.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.301 0.572 . . . . 0.0 109.763 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -74.47 -32.8 62.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.221 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.72 -27.36 63.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.81 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.83 -37.32 55.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -34.31 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.196 0.522 . . . . 0.0 109.877 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.99 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.0 tp -69.73 -51.98 29.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.465 179.566 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.408 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.95 -26.41 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.2 m -73.95 -40.81 62.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.104 179.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.99 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.3 -49.4 77.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.745 -179.926 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.936 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.85 -39.42 89.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.294 179.542 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.83 -36.21 64.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.2 179.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -50.13 68.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.268 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 2.1 mmtt -62.54 -28.61 69.97 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.731 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.54 33.56 2.87 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.609 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.7 m-85 -101.46 157.6 16.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 110.736 179.564 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.69 93.3 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.879 179.254 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.6 p -80.5 157.15 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.151 0.501 . . . . 0.0 111.136 -178.707 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.526 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.98 140.07 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.429 -178.768 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.498 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -118.5 116.61 51.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.565 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.588 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.616 179.42 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 21.3 m-85 . . . . . 0 C--O 1.225 -0.228 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.47 151.82 25.05 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.128 0.489 . . . . 0.0 111.496 -179.713 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.634 HG21 ' HB3' ' A' ' 26' ' ' LEU . 52.7 t -125.77 106.73 16.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.084 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.526 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.6 tt0 -105.66 141.08 37.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.936 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.6 123.59 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.524 0.678 . . . . 0.0 111.392 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.59 108.73 0.29 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 114.798 -1.092 . . . . 0.0 113.14 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.456 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.56 124.11 26.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.508 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -143.2 175.76 9.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 111.599 -179.18 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -84.52 -18.81 34.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.02 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.38 129.52 55.99 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.888 0.375 . . . . 0.0 111.084 -179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtm? -56.49 -36.87 69.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.52 -179.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -50.69 -31.69 17.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.865 0.364 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 27.3 m-80 -71.34 -49.38 43.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.699 179.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG13 ' A' ' 75' ' ' VAL . . . -60.62 -43.21 97.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.128 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.66 -52.05 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 110.835 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.9 m -55.45 -39.87 70.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.025 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -66.86 -50.37 62.72 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.737 0.779 . . . . 0.0 110.59 179.608 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.696 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -52.03 -62.04 1.88 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.382 -177.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.87 -35.2 61.29 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.939 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.1 ttt180 -63.67 -40.59 97.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.003 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.06 -40.97 95.51 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.741 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.9 mttm -61.67 -47.56 84.8 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.653 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -68.7 -25.87 65.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.79 178.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.35 -22.13 52.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.584 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.35 23.78 5.62 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.586 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.546 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.0 149.89 52.41 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.294 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.504 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 9.2 t0 -92.3 73.75 5.33 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.961 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.3 140.09 29.89 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.042 0.448 . . . . 0.0 111.887 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.1 pt -133.7 153.14 36.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.891 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.665 HG22 HG13 ' A' ' 12' ' ' VAL . 89.3 t -105.77 138.6 30.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.005 0.431 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 pt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.405 -179.957 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 26.2 mt . . . . . 0 CA--C 1.516 -0.352 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.53 106.93 18.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.1 0.476 . . . . 0.0 110.017 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.1 mttt -127.98 155.32 44.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.45 137.82 38.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.364 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.452 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 60.9 tt0 -128.91 135.29 48.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.906 -179.436 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.599 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.79 -4.69 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -178.777 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.26 175.99 29.81 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.616 -1.754 . . . . 0.0 115.273 178.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.533 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.67 144.37 24.32 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.247 178.06 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.528 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -152.69 144.21 23.4 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.988 0.423 . . . . 0.0 111.51 -179.526 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -16.27 1.76 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.202 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -108.45 127.88 64.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 112.236 -179.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.3 ttpt -69.83 -42.03 74.16 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.636 179.588 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -35.28 49.53 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.183 0.515 . . . . 0.0 109.758 179.108 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -74.6 -33.08 62.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.303 178.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.511 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -70.76 -25.76 63.05 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.749 179.091 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.16 -36.63 47.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -66.48 -35.4 80.19 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.993 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.8 tp -69.02 -52.57 27.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.442 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.07 -25.96 47.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.482 . . . . 0.0 110.647 179.043 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.8 t -74.66 -40.4 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.993 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.64 -48.9 79.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.62 -179.883 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.945 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.16 -39.63 90.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.157 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.56 -36.1 63.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.279 179.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.67 -51.6 62.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.66 -28.72 70.11 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.746 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.03 34.82 2.47 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.662 178.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -101.83 159.07 15.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.911 0.386 . . . . 0.0 110.723 179.391 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.44 94.43 9.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.12 179.382 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.562 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.55 156.83 26.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.223 0.535 . . . . 0.0 110.965 -178.681 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.561 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -156.2 137.87 5.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.511 HG13 ' HB1' ' A' ' 23' ' ' ALA . 19.6 t -116.22 114.43 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.567 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.333 -0.142 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.58 179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.533 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.0 m-85 . . . . . 0 C--O 1.225 -0.19 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.79 151.7 25.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.183 0.516 . . . . 0.0 111.512 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.675 ' HB ' HD23 ' A' ' 26' ' ' LEU . 51.0 t -125.45 105.53 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.068 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.561 ' HB3' HG23 ' A' ' 38' ' ' ILE . 7.5 tt0 -104.3 141.54 36.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.945 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.57 123.57 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.46 0.647 . . . . 0.0 111.593 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.528 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.37 107.38 0.23 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.208 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.487 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -131.96 123.46 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.529 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.34 175.16 9.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.176 0.512 . . . . 0.0 111.649 -179.224 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 p -83.43 -18.75 37.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.009 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.49 129.32 56.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.955 0.407 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -55.49 -35.9 66.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.258 -179.876 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -50.21 -32.62 16.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.453 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 9.5 m120 -70.79 -50.15 38.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.551 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.66 -44.72 93.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.169 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -57.57 -52.84 63.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 0.0 110.884 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 24.9 m -55.67 -38.94 70.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.908 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.02 -51.08 59.3 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.788 0.804 . . . . 0.0 110.475 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.661 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.24 -61.56 2.22 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.279 -177.573 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.81 -36.91 49.57 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -63.63 -39.54 94.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.859 179.141 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.94 -41.85 90.79 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.732 179.032 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.5 mttm -61.14 -48.27 82.39 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.18 -25.99 65.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.803 178.559 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.493 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.77 -21.04 52.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.497 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.34 24.21 5.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.518 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB2' ' HB1' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.35 149.81 52.4 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.162 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.5 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 46.3 t0 -92.8 73.61 4.92 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.965 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.85 139.28 31.41 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.06 0.457 . . . . 0.0 111.747 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.7 pt -132.82 149.76 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.161 179.089 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.551 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.4 t -101.88 137.22 30.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.93 0.395 . . . . 0.0 111.017 179.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.3 pt . . . . . 0 C--O 1.234 0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.237 -179.836 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.0 mt . . . . . 0 CA--C 1.516 -0.344 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.512 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -100.93 106.77 18.13 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.117 0.484 . . . . 0.0 110.058 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.98 154.78 42.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.591 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.99 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.48 138.84 33.32 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.151 179.706 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.435 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 6.7 tt0 -131.35 135.43 47.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.684 0.278 . . . . 0.0 110.985 -179.211 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.693 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -5.41 10.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.85 175.68 30.05 Favored Glycine 0 C--N 1.338 0.664 0 C-N-CA 118.772 -1.68 . . . . 0.0 115.285 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.61 142.95 23.41 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.046 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -153.06 144.17 23.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.015 0.436 . . . . 0.0 111.625 -179.348 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.93 -16.16 1.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.02 179.761 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.03 126.7 64.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 3.9 ttpt -69.39 -41.28 76.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.381 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.87 -34.28 53.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.249 0.547 . . . . 0.0 109.647 179.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.74 -33.09 62.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.161 178.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.9 -18.64 60.88 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.016 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.92 -38.62 20.83 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.67 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -67.52 -37.54 82.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.284 0.564 . . . . 0.0 109.524 178.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.846 HD12 ' ND2' ' A' ' 29' ' ' ASN . 54.3 tp -65.67 -51.91 55.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.992 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.501 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -59.06 -24.21 62.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.611 179.238 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.41 -40.55 70.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.28 179.45 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.846 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.76 -48.44 81.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.659 179.787 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.937 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.53 -42.81 88.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.519 -179.871 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -55.12 -37.23 66.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.151 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.13 -51.25 64.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.361 179.395 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 14.6 mmtt -62.64 -28.86 70.21 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.67 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.22 33.56 2.51 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.752 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -104.22 164.22 11.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.594 179.379 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.55 92.52 8.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.939 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.681 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -81.22 127.37 32.61 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.288 0.566 . . . . 0.0 111.178 -178.794 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -124.61 139.04 52.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.671 -179.217 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.9 t -116.04 113.11 42.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.196 179.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.809 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.514 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.8 m-85 . . . . . 0 N--CA 1.456 -0.135 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -109.76 151.78 26.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.42 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.693 HG12 HD11 ' A' ' 14' ' ' ILE . 67.5 t -124.03 105.41 15.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.011 179.792 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 8.4 tt0 -104.63 141.44 36.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.516 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.937 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.48 123.1 36.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.431 0.634 . . . . 0.0 111.668 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.39 108.13 0.35 Allowed Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.945 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.468 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -130.48 122.27 27.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.519 0.199 . . . . 0.0 110.468 179.586 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.47 172.64 12.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.47 . . . . 0.0 111.518 -179.295 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 t -82.87 -16.81 46.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.059 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.83 129.9 56.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.512 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.0 tmtt? -56.77 -35.31 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.264 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -50.32 -32.97 18.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 110.928 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.455 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 24.4 m-80 -70.71 -49.59 45.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.725 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.46 -42.93 93.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.117 179.801 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -58.84 -52.15 66.97 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.106 -179.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -58.18 -35.79 72.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.921 -179.93 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.99 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.51 35.28 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 121.757 0.789 . . . . 0.0 110.188 179.561 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.72 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.62 -60.62 3.1 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.064 -177.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.85 51.55 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.663 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.6 ttt180 -63.1 -38.16 90.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.814 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.68 -41.99 91.78 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.723 179.085 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 43.4 mttm -61.39 -47.59 85.13 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.621 178.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -68.91 -25.44 64.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.69 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.43 -21.96 52.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.392 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.78 24.2 5.63 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.375 -179.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.542 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.78 149.09 52.58 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -179.214 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.6 t70 -92.25 71.89 5.33 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.695 179.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.25 141.39 30.14 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-O 121.09 0.471 . . . . 0.0 111.731 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.08 152.62 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.572 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.0 t -104.73 135.19 43.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.875 0.369 . . . . 0.0 110.953 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.36 -179.953 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 CA--C 1.515 -0.367 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.523 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.8 m-85 -101.25 107.28 18.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.109 0.48 . . . . 0.0 109.974 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.3 mttm -126.08 155.37 41.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.4 179.802 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.999 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.07 137.49 40.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.212 179.811 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tt0 -128.44 133.4 48.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.675 0.274 . . . . 0.0 111.409 -179.357 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.935 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -98.6 -5.61 9.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.13 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 151.31 -176.49 29.75 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 119.037 -1.554 . . . . 0.0 114.813 178.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.534 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -152.35 144.41 23.81 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.929 -0.636 . . . . 0.0 109.428 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.501 ' HE2' HD22 ' A' ' 26' ' ' LEU . 16.7 m-85 -153.22 141.89 20.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.914 0.388 . . . . 0.0 111.532 -179.595 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -15.57 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.892 179.793 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.35 123.31 62.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.076 0.465 . . . . 0.0 112.165 -179.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -67.19 -41.03 86.55 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.23 179.262 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.43 -31.89 47.33 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.205 0.526 . . . . 0.0 109.704 178.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -76.42 -32.38 58.44 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.263 178.336 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -77.21 -17.25 58.64 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.095 179.086 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -84.47 -38.68 19.84 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.339 0.59 . . . . 0.0 109.719 178.917 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.726 HD12 ' ND2' ' A' ' 29' ' ' ASN . 12.0 tp -66.86 -56.89 8.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.482 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.676 ' HB2' HG13 ' A' ' 48' ' ' VAL . . . -56.75 -33.66 66.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.149 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 m -61.27 -40.88 95.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.41 179.614 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.726 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -61.38 -43.38 98.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.45 179.655 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.95 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.39 -41.98 98.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.11 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -55.04 -35.99 65.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.137 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.4 -51.48 64.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.277 179.371 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 8.5 mmtt -62.63 -28.55 69.98 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.9 33.46 2.6 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.3 -0.863 . . . . 0.0 112.775 178.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.6 m-85 -102.37 158.92 15.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.917 0.389 . . . . 0.0 110.904 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.56 92.72 8.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.738 179.22 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 16.1 p -80.69 158.52 25.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.191 0.519 . . . . 0.0 111.339 -178.642 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.82 141.71 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.479 -178.818 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.419 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.6 t -118.84 115.84 49.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.513 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.59 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.455 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 22.9 m-85 . . . . . 0 C--O 1.226 -0.171 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.74 148.94 27.83 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.238 0.542 . . . . 0.0 111.752 -179.362 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.935 HG12 HD11 ' A' ' 14' ' ' ILE . 61.9 t -120.31 106.17 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.919 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.544 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.3 tt0 -105.57 139.89 39.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.001 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.95 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.88 124.03 36.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.459 0.647 . . . . 0.0 111.64 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.21 108.99 0.28 Allowed Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.197 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.445 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.12 115.49 15.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.682 0.277 . . . . 0.0 110.425 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.55 175.93 8.99 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.057 0.456 . . . . 0.0 111.564 -179.256 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 p -84.56 -18.29 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.023 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.43 128.71 56.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.865 0.364 . . . . 0.0 111.105 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.5 tmtm? -55.59 -36.42 66.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.259 -179.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -51.65 -32.01 27.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 4.1 m120 -70.67 -49.5 46.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.77 -41.66 91.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.082 179.656 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -59.14 -51.5 69.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.994 -179.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -36.71 71.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.832 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.999 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.46 -50.64 43.58 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.667 0.746 . . . . 0.0 110.15 179.543 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.753 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.44 -60.57 3.14 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.06 -177.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.66 -37.42 58.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.709 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -63.82 -38.51 91.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 0.0 109.804 179.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.3 -41.75 93.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.759 179.114 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.1 OUTLIER -62.0 -46.5 88.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.614 178.841 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.88 -25.79 64.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.642 178.253 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.85 -21.95 54.26 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.266 179.608 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.01 24.12 5.87 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.936 -0.649 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.527 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 0.9 OUTLIER -130.56 152.14 50.26 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.139 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 17.9 t70 -94.47 71.35 3.71 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.949 -0.301 . . . . 0.0 111.199 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -88.81 140.5 29.38 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 121.062 0.458 . . . . 0.0 111.667 179.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 13.7 pt -134.21 157.66 41.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.837 179.259 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 97.1 t -105.23 137.24 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.918 0.389 . . . . 0.0 111.158 179.888 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.393 -179.869 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.7 mt . . . . . 0 CA--C 1.517 -0.322 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.7 m-85 -101.4 106.8 17.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.011 0.434 . . . . 0.0 109.86 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.83 153.5 46.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.495 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.078 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.82 139.26 27.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.388 -179.942 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -130.42 137.52 49.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.586 0.232 . . . . 0.0 111.222 -179.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.701 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -109.92 -6.23 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.89 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.59 175.02 30.08 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 118.713 -1.708 . . . . 0.0 115.355 178.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.498 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.44 145.37 25.18 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.554 -0.823 . . . . 0.0 109.031 178.141 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.28 148.22 26.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 111.611 -179.188 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -55.61 -17.23 5.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.732 179.703 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.6 t -108.65 129.88 62.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.019 0.438 . . . . 0.0 111.948 -179.487 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -73.74 -37.68 65.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.312 179.612 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.43 64.23 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.297 0.57 . . . . 0.0 109.527 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -72.99 -32.15 64.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.986 178.107 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.44 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.4 -20.0 60.85 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.805 179.055 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -82.11 -37.33 26.46 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.726 179.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.5 t -69.35 -35.93 76.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.796 179.037 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.844 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -66.39 -51.75 53.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.358 179.393 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.614 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.75 -27.85 65.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.097 0.475 . . . . 0.0 110.417 179.072 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 t -67.7 -41.58 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.599 179.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.844 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.06 -47.63 85.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.622 179.651 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.902 ' HB1' HG21 ' A' ' 50' ' ' ILE . . . -60.64 -41.77 95.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.525 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -54.54 -36.36 64.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.244 179.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.41 -51.4 65.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.9 mmtt -62.67 -28.81 70.18 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.678 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.01 34.63 2.52 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.636 178.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.72 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -102.66 159.44 15.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.899 0.381 . . . . 0.0 110.802 179.631 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -87.6 93.82 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.252 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.614 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 41.2 p -79.02 152.87 30.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.973 -178.957 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.612 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -152.29 135.0 6.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 12.0 t -111.87 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.32 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.674 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' HD2' HG12 ' A' ' 39' ' ' VAL . 25.5 m-85 . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -116.27 154.08 30.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.983 0.42 . . . . 0.0 111.067 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.701 HG12 HD11 ' A' ' 14' ' ' ILE . 91.7 t -122.95 117.51 52.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.976 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.612 ' HB3' HG23 ' A' ' 38' ' ' ILE . 10.1 tt0 -119.15 143.99 46.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.344 -179.136 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.902 HG21 ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -137.28 140.87 41.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.971 178.993 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.469 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 69.38 97.14 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.971 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.89 112.52 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.166 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -135.89 171.05 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 111.633 -178.802 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -79.44 -16.42 56.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.767 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.01 132.14 56.69 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.913 0.387 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.8 ttpt -58.48 -36.74 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -46.71 -32.76 3.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.462 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 5.5 m120 -71.75 -50.08 33.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.609 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.2 -43.31 82.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.02 179.523 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.58 -51.17 71.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -57.93 -38.57 76.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.848 179.957 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.078 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.82 -52.23 39.34 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.727 0.775 . . . . 0.0 110.395 179.509 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.671 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.04 -60.73 2.91 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.18 -177.808 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.95 -36.39 49.14 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.467 179.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.54 -39.89 92.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.047 179.035 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.82 -41.52 95.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.591 179.113 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.4 mttm -61.87 -47.31 85.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.661 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -69.43 -25.12 63.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.703 178.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.497 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.63 -22.11 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.299 179.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.33 23.09 5.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.843 -0.694 . . . . 0.0 111.418 -179.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.14 148.14 51.95 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -179.248 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.442 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -91.8 74.43 5.73 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.772 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.81 140.92 29.22 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.129 0.49 . . . . 0.0 111.855 179.981 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.623 HD12 HG23 ' A' ' 76' ' ' ILE . 1.9 pp -133.49 151.46 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.957 179.196 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.609 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.7 t -101.54 136.22 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.846 0.355 . . . . 0.0 110.955 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.623 HG23 HD12 ' A' ' 74' ' ' ILE . 18.6 pt . . . . . 0 C--O 1.236 0.369 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.244 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 CA--C 1.517 -0.295 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.5 m-85 -101.28 106.01 17.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.115 0.483 . . . . 0.0 110.163 179.681 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.46 153.38 43.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.359 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.004 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.55 141.55 20.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.379 179.84 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -133.73 132.74 40.95 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.728 0.299 . . . . 0.0 111.243 -178.945 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.559 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.08 -5.9 10.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.057 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.96 173.02 29.06 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 118.951 -1.595 . . . . 0.0 114.778 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.53 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.03 137.26 18.42 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 114.986 -0.607 . . . . 0.0 109.625 178.45 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.596 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.3 m-85 -146.29 150.54 35.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.873 0.368 . . . . 0.0 111.102 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -61.31 -12.91 15.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.937 -179.87 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.36 129.46 62.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.011 0.434 . . . . 0.0 111.965 -179.402 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 ttpt -71.4 -40.1 70.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.579 179.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.15 -33.62 58.42 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -76.48 -32.03 58.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.354 178.349 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.613 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.04 -20.6 60.25 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.999 179.271 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.91 -38.47 21.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.693 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -67.34 -36.71 81.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 109.696 179.104 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -67.2 -51.57 51.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.253 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.573 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.57 -24.4 60.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.369 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -41.66 67.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.559 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.13 -47.06 86.67 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.391 179.816 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.74 -40.76 93.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.668 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -55.13 -36.91 66.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.203 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -51.35 62.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.24 179.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.542 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.48 -28.6 69.94 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.673 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.06 32.35 3.07 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.542 179.111 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.792 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.5 156.77 17.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.897 0.38 . . . . 0.0 110.776 179.506 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.27 93.63 8.73 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.66 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.626 ' HA ' HG22 ' A' ' 50' ' ' ILE . 54.1 p -80.16 156.76 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.076 0.465 . . . . 0.0 111.107 -178.638 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.13 139.13 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.716 -178.641 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.613 HG13 ' HB1' ' A' ' 23' ' ' ALA . 24.0 t -113.75 110.72 33.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.18 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.332 -0.192 0 CA-C-O 121.008 0.432 . . . . 0.0 110.663 179.798 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' ' N ' ' A' ' 17' ' ' PHE . 26.1 m-85 . . . . . 0 C--O 1.228 -0.034 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.49 157.18 29.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.031 0.443 . . . . 0.0 111.338 -179.836 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.707 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.5 t -124.67 110.99 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.407 -179.701 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.1 tt0 -110.24 141.01 43.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.422 179.821 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.11 123.1 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.45 0.643 . . . . 0.0 111.652 179.702 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.527 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.13 100.13 0.3 Allowed Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.9 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.25 123.18 40.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.369 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -142.8 170.25 16.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.122 0.486 . . . . 0.0 111.501 -179.112 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.5 p -80.47 -16.4 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.903 179.537 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.55 131.05 56.79 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.893 0.378 . . . . 0.0 110.95 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 19.5 ttpp -57.52 -36.74 71.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.404 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -46.43 -32.17 3.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.977 0.418 . . . . 0.0 110.917 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.584 ' O ' HG22 ' A' ' 61' ' ' THR . 7.9 m120 -73.79 -48.7 29.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.356 179.647 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.579 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.78 -45.62 91.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.132 179.653 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -59.07 -53.07 62.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.702 0.287 . . . . 0.0 111.22 -179.649 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.584 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.8 t -58.87 -34.4 71.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.938 0.399 . . . . 0.0 111.034 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.004 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.85 -52.95 20.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.87 0.843 . . . . 0.0 110.195 179.522 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.745 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.73 -58.49 7.01 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.97 -177.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.96 -37.28 60.99 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.468 179.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.2 ttt180 -64.16 -39.06 93.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.764 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.03 -40.44 96.33 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.45 179.075 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.02 91.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.556 178.741 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -70.25 -25.51 63.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.878 178.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -77.17 -22.96 51.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.374 179.784 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.31 23.67 5.38 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.547 -179.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.547 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.22 148.28 52.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 -179.245 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.3 t0 -92.31 73.72 5.32 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.779 179.594 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.96 142.86 29.34 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.082 0.468 . . . . 0.0 111.806 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.2 pt -134.66 153.06 34.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.579 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.1 t -103.75 135.38 41.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 111.073 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.225 -179.909 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.516 -0.339 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.3 m-85 -101.76 106.97 18.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.163 0.506 . . . . 0.0 109.937 179.582 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.402 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.3 mttt -125.93 152.88 45.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.349 179.784 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.011 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.23 142.57 17.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.171 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -135.51 134.19 39.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.853 0.359 . . . . 0.0 111.423 -178.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.531 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.23 -5.65 10.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -179.328 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.78 173.97 27.88 Favored Glycine 0 C--N 1.338 0.672 0 C-N-CA 119.215 -1.469 . . . . 0.0 114.421 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.761 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 147.95 27.36 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.092 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.566 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -152.22 151.64 31.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 111.268 -179.384 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -60.89 -14.36 21.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.345 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.93 128.43 61.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.955 0.407 . . . . 0.0 111.76 -179.75 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.8 -36.86 70.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.247 179.639 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.16 -32.6 70.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 109.779 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -76.98 -34.33 57.56 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.109 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.54 -19.39 61.52 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.659 178.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -83.73 -38.29 21.57 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.345 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.0 t -65.28 -37.03 85.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.309 0.576 . . . . 0.0 109.644 178.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.931 HD12 ' OD1' ' A' ' 29' ' ' ASN . 40.3 tp -67.91 -48.7 65.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.137 179.172 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.62 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -57.35 -26.22 60.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.143 0.497 . . . . 0.0 110.369 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.24 -40.45 62.39 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.07 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.931 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.32 -48.55 81.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.939 0.4 . . . . 0.0 110.633 -179.977 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.956 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.46 -38.35 89.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.84 -36.64 65.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.416 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.71 -51.42 60.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.524 179.546 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.34 -28.04 69.48 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.804 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.28 33.63 2.91 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.491 179.025 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.801 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.0 157.96 16.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.687 179.356 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.37 95.92 9.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.144 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.62 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 54.7 p -80.36 155.2 27.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.17 0.51 . . . . 0.0 110.973 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.66 139.96 8.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.783 -178.643 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.594 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.34 116.4 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.497 -179.712 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.606 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.904 0.383 . . . . 0.0 110.337 179.795 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.452 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 27.4 m-85 . . . . . 0 N--CA 1.457 -0.118 0 CA-C-O 120.736 0.303 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.761 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.71 148.42 30.48 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 120.996 0.427 . . . . 0.0 111.114 -179.912 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.73 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.0 t -120.03 99.08 6.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.648 179.606 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.8 OUTLIER -102.56 140.84 36.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.701 -179.62 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.956 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.01 123.05 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 111.324 179.623 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.28 103.56 0.2 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.819 179.897 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -125.43 124.41 41.4 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.35 174.38 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.088 0.471 . . . . 0.0 111.606 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.17 -17.27 43.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.984 179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.6 t -112.6 128.73 56.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtt? -56.68 -34.69 67.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.225 -179.881 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.51 -32.66 28.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.853 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 79.7 m-20 -70.49 -49.52 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.65 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.585 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.2 -41.56 88.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.91 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.95 -51.15 70.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.8 0.333 . . . . 0.0 110.804 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.0 m -58.66 -35.89 73.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 -180.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.011 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.07 -51.56 30.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.766 0.793 . . . . 0.0 110.161 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.743 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.65 -58.49 7.01 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.938 -177.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -36.76 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.02 -38.87 92.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.559 178.937 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.18 -40.75 94.67 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.476 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.9 mttm -62.07 -47.21 85.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.624 178.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -68.68 -25.89 65.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.66 178.52 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.11 -21.94 53.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.394 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.07 23.45 5.82 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.409 -179.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.86 148.55 52.64 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.354 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -92.21 74.52 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.08 142.29 28.81 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.082 0.468 . . . . 0.0 112.003 179.89 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 10.1 pt -135.53 153.09 32.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.062 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.3 t -103.04 135.94 38.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.903 0.382 . . . . 0.0 110.914 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 C--O 1.236 0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.153 -179.866 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.6 mt . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.491 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -101.04 106.73 18.04 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.423 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -126.51 155.85 41.69 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.532 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.056 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.68 138.28 34.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.29 179.845 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -130.49 134.98 47.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.767 0.318 . . . . 0.0 111.104 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.559 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.27 -5.25 10.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.145 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.62 171.15 28.45 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 119.15 -1.5 . . . . 0.0 114.687 179.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.62 140.95 22.33 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.476 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.526 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.6 m-85 -149.85 149.62 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.0 111.361 -179.323 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -15.41 23.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.525 179.843 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -104.93 128.66 58.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.041 0.448 . . . . 0.0 111.765 -179.711 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.84 -38.92 70.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.452 179.772 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -32.39 65.24 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.168 0.509 . . . . 0.0 109.85 179.153 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.68 -33.86 53.15 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.25 178.511 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.53 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.8 -22.48 61.57 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.806 179.116 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -81.66 -38.83 25.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -64.0 -37.54 87.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.319 0.58 . . . . 0.0 109.72 179.021 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.959 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.5 tp -67.62 -46.33 72.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.206 179.357 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.538 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.49 -26.35 65.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.119 0.485 . . . . 0.0 110.631 179.187 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -74.82 -40.62 60.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.071 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.959 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.72 -48.58 81.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.911 0.386 . . . . 0.0 110.747 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.61 -38.3 89.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.333 179.472 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -55.18 -36.61 66.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.481 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.5 -50.29 65.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.388 179.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 6.1 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.709 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 32.65 3.1 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.554 179.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.2 m-85 -100.89 156.8 17.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.93 0.395 . . . . 0.0 110.72 179.639 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.52 94.19 8.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.009 179.422 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.57 ' HA ' HG22 ' A' ' 50' ' ' ILE . 86.3 p -80.24 155.98 27.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.114 0.483 . . . . 0.0 110.968 -178.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.568 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.22 142.33 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.761 -178.525 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 35.4 t -120.21 117.86 54.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.366 -179.759 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.589 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.981 0.42 . . . . 0.0 110.572 179.681 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 20' ' ' LYS . 31.0 m-85 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.669 0.271 . . . . 0.0 110.324 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.816 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.48 149.45 27.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.983 0.421 . . . . 0.0 111.528 -179.85 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.814 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.9 t -121.81 100.97 9.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.29 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -106.84 141.9 37.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.543 -178.831 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.78 123.48 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-O 121.469 0.652 . . . . 0.0 111.414 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.69 105.33 0.25 Allowed Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.004 179.671 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.44 115.49 18.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.628 0.252 . . . . 0.0 110.429 179.525 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.56 171.04 14.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.045 0.45 . . . . 0.0 111.544 -179.328 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.99 -18.33 50.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.02 133.05 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.934 0.397 . . . . 0.0 111.089 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.491 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 7.7 ttpt -58.82 -38.27 78.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.443 -179.708 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.01 -32.23 2.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.998 0.427 . . . . 0.0 110.839 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.45 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 65.3 m-80 -72.52 -49.23 34.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.413 179.638 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.637 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.97 -44.66 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.255 179.657 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -59.17 -50.78 72.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 4.6 m -58.9 -36.23 74.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.793 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.056 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.34 -51.69 34.48 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.808 0.813 . . . . 0.0 110.293 179.446 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.1 -59.25 4.9 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.039 -177.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.41 -36.17 53.55 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.37 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.6 ttt180 -65.29 -38.95 91.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.727 178.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.72 -41.69 91.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.645 178.965 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.577 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.87 87.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.165 0.507 . . . . 0.0 109.662 178.773 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -69.34 -25.77 64.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.753 178.534 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.9 -22.65 53.08 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.91 23.9 5.41 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.481 -179.303 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.577 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.81 148.73 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.325 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.465 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.3 t0 -92.54 75.41 5.11 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.936 179.965 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.55 141.4 29.07 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 121.228 0.537 . . . . 0.0 111.931 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.6 pt -133.68 151.02 32.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.984 179.122 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.637 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.2 t -101.33 137.88 27.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.938 0.399 . . . . 0.0 111.03 -179.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 pt . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.179 -179.936 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt . . . . . 0 CA--C 1.516 -0.337 0 CA-C-O 120.878 0.371 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.7 m-85 -101.69 106.25 17.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.838 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.451 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 19.1 mttt -125.11 152.32 44.55 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.473 179.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.041 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.17 139.87 24.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.197 179.712 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -132.61 134.56 45.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.792 0.33 . . . . 0.0 111.282 -179.135 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.578 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.77 -5.74 10.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.234 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.13 172.62 27.6 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 119.18 -1.486 . . . . 0.0 114.707 178.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.773 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.54 147.95 27.42 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.545 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.3 m-85 -152.21 153.11 33.16 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.485 -179.293 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -59.8 -17.29 34.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.295 179.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.04 130.63 57.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.046 0.45 . . . . 0.0 111.915 -179.394 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -72.92 -38.21 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.231 179.515 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.18 66.24 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -75.46 -33.61 60.86 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.099 178.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.567 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.33 -20.81 61.42 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.649 179.054 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.4 -37.48 25.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.47 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.5 t -66.19 -37.23 85.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.772 179.085 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.935 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.19 -47.06 68.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.259 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.674 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.87 -26.07 65.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.055 0.455 . . . . 0.0 110.349 178.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.54 61.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.091 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.935 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.64 -48.34 82.05 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 120.863 0.363 . . . . 0.0 110.616 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.58 -38.33 89.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.243 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -54.74 -36.61 64.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.387 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.67 -51.22 61.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.472 179.483 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.45 -28.2 69.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.73 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.44 33.24 2.97 Favored Glycine 0 N--CA 1.444 -0.775 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.44 179.025 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.732 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.9 m-85 -100.47 156.93 17.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.917 0.389 . . . . 0.0 110.628 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.96 95.21 8.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.935 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.674 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 51.5 p -80.14 155.01 27.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.174 0.512 . . . . 0.0 110.88 -178.801 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.55 139.34 8.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 -178.47 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.61 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.3 t -117.13 116.04 50.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.505 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.624 ' C ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.875 0.369 . . . . 0.0 110.436 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 16' ' ' ALA . 27.8 m-85 . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.773 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.22 148.97 29.19 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 111.266 -179.749 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.745 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.9 t -121.62 99.41 7.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.579 179.666 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.619 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.4 tt0 -104.02 142.25 34.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.907 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.39 123.25 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.623 0.725 . . . . 0.0 111.281 179.423 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.13 101.62 0.23 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.768 -1.106 . . . . 0.0 112.888 179.726 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.569 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -124.99 116.42 22.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.664 0.269 . . . . 0.0 110.399 179.493 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.29 171.09 14.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.084 0.469 . . . . 0.0 111.637 -179.209 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.4 p -80.43 -17.86 50.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.956 179.556 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -113.41 131.75 55.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.947 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 14.7 ttpt -57.64 -39.35 76.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.488 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -45.88 -32.1 2.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.02 0.438 . . . . 0.0 110.927 -179.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 73.2 m-80 -72.15 -49.41 36.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.308 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.628 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.49 -43.86 84.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.066 179.645 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.11 -49.81 76.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.872 0.368 . . . . 0.0 110.933 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.46 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.8 m -59.46 -36.06 75.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.041 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.0 -52.74 21.71 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 121.792 0.806 . . . . 0.0 110.282 179.479 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.742 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.98 -58.22 8.12 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.982 -177.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.89 -37.0 60.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.348 179.361 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.74 -39.79 94.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.715 179.016 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.69 -40.93 96.23 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.572 179.009 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.3 OUTLIER -62.13 -46.99 86.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.562 178.834 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -69.44 -25.57 64.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.791 178.618 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.82 -22.6 53.37 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.459 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 23.49 5.66 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 -179.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.555 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.66 148.4 52.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.386 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.6 t70 -91.98 74.65 5.59 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.79 140.39 30.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.085 0.469 . . . . 0.0 111.88 179.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.429 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.4 pt -132.66 151.97 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.925 179.098 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.628 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.3 t -102.61 137.14 31.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.893 0.378 . . . . 0.0 111.114 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.962 -179.877 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 tp . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.764 0.316 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.9 mttt 59.84 104.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.0 155.26 29.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.823 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.0 m 62.73 119.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.847 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.0 p -71.57 134.62 46.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.84 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.8 m -106.32 115.78 30.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.979 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t -166.14 91.62 0.47 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.885 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.539 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 85.62 156.69 27.44 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.545 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.2 mt -143.61 139.82 29.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.521 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.1 m-85 -101.79 105.91 16.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.069 0.461 . . . . 0.0 110.186 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 19.0 mttt -125.21 151.91 45.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.332 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -103.85 142.62 17.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.184 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -136.33 131.94 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.863 0.363 . . . . 0.0 111.342 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.536 HD13 HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -105.36 -5.46 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.69 173.54 28.3 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 119.236 -1.459 . . . . 0.0 114.43 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.725 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.41 142.74 23.38 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.605 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -147.75 150.62 34.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.038 0.447 . . . . 0.0 111.405 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' HG3' HD23 ' A' ' 45' ' ' LEU . 8.0 ttmt -60.54 -15.07 23.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.415 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.4 t -106.54 129.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 121.112 0.482 . . . . 0.0 111.785 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.2 ttpt -71.88 -39.17 69.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.512 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.72 -32.0 66.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.132 0.491 . . . . 0.0 109.827 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -77.51 -34.43 54.04 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.259 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.38 -19.49 60.98 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.839 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.67 -38.34 21.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.48 -38.03 88.58 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.803 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.5 tp -65.95 -50.06 65.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.217 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.54 -24.32 60.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.485 179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.85 -41.5 64.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.612 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.803 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -58.68 -47.38 84.68 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.513 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.51 -40.29 94.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.522 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.71 -37.31 65.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.304 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.32 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.36 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -62.5 -28.48 69.87 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.66 32.92 3.0 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.54 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.799 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -100.35 155.88 17.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -85.02 94.51 8.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.8 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.591 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.6 p -80.17 156.0 27.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.175 0.512 . . . . 0.0 111.017 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.66 137.71 7.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.913 -178.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 47.5 t -114.98 113.86 44.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.028 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.836 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -112.87 125.27 54.18 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.006 0.431 . . . . 0.0 110.499 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.836 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -88.07 114.04 24.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.319 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.663 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -98.7 166.82 11.14 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.474 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 12.4 t70 -55.18 66.94 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -178.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.9 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.98 -23.93 3.48 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 120.135 -1.031 . . . . 0.0 115.036 178.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 44' ' ' GLY . 20.1 mt -143.4 166.21 25.4 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.163 0.982 . . . . 0.0 112.744 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.562 ' OH ' HD22 ' A' ' 41' ' ' LEU . 27.9 m-85 -112.97 134.18 54.6 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.15 -0.932 . . . . 0.0 109.454 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.725 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.88 148.24 29.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.129 0.49 . . . . 0.0 111.815 -179.243 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.743 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.2 t -120.77 101.62 10.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.787 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.646 ' HB3' HG23 ' A' ' 38' ' ' ILE . 1.9 tt0 -107.5 142.19 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.864 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.13 123.07 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.518 0.675 . . . . 0.0 111.449 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.552 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.11 105.57 0.22 Allowed Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.865 179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.571 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.1 124.87 40.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.647 0.261 . . . . 0.0 110.505 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.69 172.99 11.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.136 0.493 . . . . 0.0 111.499 -179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -83.04 -15.92 49.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.997 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.48 128.52 56.36 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.898 0.38 . . . . 0.0 111.028 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -56.32 -34.92 67.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.212 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.48 -30.88 32.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.443 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 63.9 m-80 -70.8 -50.24 37.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.681 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.599 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.75 -40.2 87.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.926 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -60.47 -51.47 69.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -59.02 -35.98 74.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.939 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.63 -52.04 29.52 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.846 0.831 . . . . 0.0 110.131 179.518 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.69 -59.05 5.11 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.993 -177.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.6 -36.75 56.9 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.522 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.5 ttt180 -64.33 -38.72 92.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.766 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.94 -40.88 95.71 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.543 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.9 mttm -61.86 -46.88 87.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.678 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.52 -25.69 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.817 178.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.475 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.08 -22.54 52.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.4 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.1 23.93 5.34 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.581 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.41 148.46 52.66 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.6 t70 -92.33 74.32 5.3 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.579 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.682 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.33 142.9 29.85 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-O 121.234 0.54 . . . . 0.0 111.845 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.51 152.74 34.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.016 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.599 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.8 t -104.91 134.75 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.902 0.382 . . . . 0.0 110.848 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.5 tt -135.68 139.24 46.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.286 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.539 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.2 tp -96.74 104.44 16.44 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.139 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -104.7 129.06 52.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.842 0.353 . . . . 0.0 111.305 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.191 -0.909 . . . . 0.0 110.904 179.906 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.859 0.361 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 58.79 170.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.969 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -123.02 176.7 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.859 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.3 p -110.02 142.8 40.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -106.19 31.03 5.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.49 -66.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.5 m -78.34 132.64 37.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.888 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -77.78 -165.62 26.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.508 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.9 mt -143.84 140.31 29.76 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.9 m-85 -101.7 105.74 16.68 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.127 0.489 . . . . 0.0 110.241 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -125.4 157.3 37.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.019 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -110.57 136.24 47.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.356 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.096 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.5 135.32 47.83 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 111.453 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.652 ' CG2' ' HB2' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.32 -6.16 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.47 177.0 29.21 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 119.176 -1.488 . . . . 0.0 114.595 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.646 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 144.05 24.12 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.635 ' HE1' HD22 ' A' ' 26' ' ' LEU . 5.0 m-85 -147.86 149.65 32.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.382 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.492 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.37 -14.31 26.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.47 179.638 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 125.28 62.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.041 0.448 . . . . 0.0 111.985 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.2 tmtt? -67.11 -41.01 86.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.492 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.65 66.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.118 0.485 . . . . 0.0 109.906 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -77.93 -35.46 50.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.391 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.98 -19.08 61.29 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.802 179.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.53 -37.51 21.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.639 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -37.33 86.14 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.826 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.5 tp -66.82 -51.01 60.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.999 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.15 -24.62 59.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.599 179.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -72.53 -41.41 65.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.519 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.826 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.89 -47.71 84.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.588 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.87 -40.91 94.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.597 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -55.22 -37.14 66.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.382 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.91 -50.85 65.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.235 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.7 mmtt -62.45 -28.53 69.87 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.5 31.52 3.21 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.519 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.6 m-85 -100.49 157.26 16.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 0.0 110.794 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -86.81 93.98 9.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.758 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.621 ' HA ' HG22 ' A' ' 50' ' ' ILE . 99.2 p -80.29 157.78 26.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.138 0.494 . . . . 0.0 110.918 -178.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.525 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.27 138.51 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.01 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.592 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.1 t -117.41 116.71 52.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.023 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.857 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -113.06 125.14 54.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.0 110.692 179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.857 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -86.49 114.16 23.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.195 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.677 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.6 167.02 10.61 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.1 m-20 -54.93 65.16 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.893 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.4 -23.24 3.65 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.116 -1.04 . . . . 0.0 115.035 178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.893 HD23 ' O ' ' A' ' 44' ' ' GLY . 22.9 mt -142.43 163.57 32.47 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.263 1.032 . . . . 0.0 113.035 -178.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.511 ' OH ' HD22 ' A' ' 41' ' ' LEU . 27.8 m-85 -111.95 132.16 54.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.53 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.88 146.55 28.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.126 0.489 . . . . 0.0 111.722 -179.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.784 ' CB ' HD23 ' A' ' 26' ' ' LEU . 99.4 t -120.99 102.59 12.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.678 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.525 ' HB3' HG23 ' A' ' 38' ' ' ILE . 36.3 tt0 -111.38 143.76 41.68 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.274 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.38 123.82 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.525 0.679 . . . . 0.0 111.454 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.53 109.78 0.29 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.04 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -132.85 122.38 24.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.747 0.308 . . . . 0.0 110.259 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.66 175.44 9.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.071 0.462 . . . . 0.0 111.621 -179.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.65 -15.38 39.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.124 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.7 t -112.07 126.94 55.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -55.63 -36.28 66.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.178 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -53.04 -30.05 33.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.904 0.383 . . . . 0.0 110.99 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.474 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 2.7 m-80 -72.84 -49.37 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.741 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.456 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.81 -40.96 94.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.003 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -60.38 -49.99 75.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.824 0.345 . . . . 0.0 110.83 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.7 m -58.01 -37.77 74.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.783 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.019 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.8 -50.42 50.42 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.782 0.801 . . . . 0.0 110.177 179.297 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.737 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.2 -60.81 2.82 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.306 -1.315 . . . . 0.0 111.098 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.7 54.28 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.691 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.413 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.46 -38.02 88.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.75 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.67 -41.71 92.15 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.714 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.3 mttm -62.04 -46.37 89.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.597 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.28 -25.73 63.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.737 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.485 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.23 -23.83 54.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.8 24.51 4.9 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.963 -0.637 . . . . 0.0 111.546 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.68 149.03 52.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.26 72.51 4.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.83 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 144.75 26.52 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.07 0.462 . . . . 0.0 111.69 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.0 pp -133.43 157.67 42.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.756 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 12' ' ' VAL . 84.0 t -109.84 134.68 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.976 0.417 . . . . 0.0 111.029 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.565 HD12 ' HG3' ' A' ' 78' ' ' GLU . 1.7 pt -134.3 142.22 41.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.364 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.502 HD13 ' CE1' ' A' ' 10' ' ' TYR . 14.5 tp -104.41 104.29 14.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.33 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.565 ' HG3' HD12 ' A' ' 76' ' ' ILE . 15.5 mt-10 -133.8 143.73 48.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.909 0.385 . . . . 0.0 111.002 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.834 -179.991 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.825 0.345 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 9.4 mttm 60.55 175.56 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -100.18 172.94 6.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.25 31.49 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.903 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.05 -47.54 4.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.58 122.16 0.52 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.032 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 m -139.14 157.76 45.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.661 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.405 ' N ' HD11 ' A' ' 77' ' ' LEU . . . -175.96 -119.08 0.55 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.815 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.703 HD12 ' O ' ' A' ' 78' ' ' GLU . 2.9 mp -144.19 142.94 30.83 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.514 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.2 m-85 -101.92 106.61 17.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.077 0.465 . . . . 0.0 110.05 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.0 mttt -126.45 155.36 42.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.644 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.036 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.27 137.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.395 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -129.96 135.82 48.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.572 0.225 . . . . 0.0 110.996 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.22 -6.35 11.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -179.124 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.91 174.34 28.49 Favored Glycine 0 C--N 1.336 0.528 0 C-N-CA 119.047 -1.549 . . . . 0.0 114.781 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.715 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.8 143.33 23.52 Favored 'General case' 0 C--N 1.333 -0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -145.89 149.15 33.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 111.323 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.488 ' HG3' HG23 ' A' ' 19' ' ' VAL . 4.7 ptpp? -61.7 -13.56 23.93 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.345 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.488 HG23 ' HG3' ' A' ' 18' ' ' LYS . 21.3 t -107.43 126.44 63.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.061 0.458 . . . . 0.0 111.94 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 46' ' ' TYR . 5.5 tmtt? -65.87 -42.19 90.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.591 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.54 -33.13 65.8 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.166 0.508 . . . . 0.0 109.895 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -77.16 -36.21 55.37 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.44 178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.84 62.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.666 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -35.73 26.88 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.4 t -64.87 -36.69 85.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.964 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.48 -50.98 48.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.383 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -56.89 -25.25 56.54 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.067 0.46 . . . . 0.0 110.592 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -41.37 60.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.761 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.964 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.04 -48.52 81.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.845 0.355 . . . . 0.0 110.401 179.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.978 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.71 -40.35 87.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.308 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -55.37 -36.45 66.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.88 -51.74 54.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.354 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -62.83 -28.49 70.05 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.5 34.25 2.92 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.502 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.77 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.6 m-85 -100.84 156.12 17.55 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 121.126 0.488 . . . . 0.0 110.92 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -83.33 89.92 7.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.529 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.657 ' HA ' HG22 ' A' ' 50' ' ' ILE . 1.1 m -80.33 158.68 26.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 110.526 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.501 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -156.87 141.64 8.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.17 -178.372 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 58.8 t -117.81 116.5 51.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.005 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.836 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -113.51 124.89 53.47 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.813 0.339 . . . . 0.0 110.658 179.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.836 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -87.36 115.88 25.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.314 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -102.84 166.8 10.26 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.089 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.499 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 46.2 m-20 -54.8 65.4 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.891 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 133.1 -22.18 4.04 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 120.234 -0.984 . . . . 0.0 115.186 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.891 HD23 ' O ' ' A' ' 44' ' ' GLY . 28.3 mt -141.89 160.15 40.78 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.248 1.024 . . . . 0.0 113.006 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.594 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.0 m-85 -111.23 130.26 55.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.492 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.06 147.92 27.35 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.175 0.512 . . . . 0.0 111.744 -179.307 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.783 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.5 t -123.08 103.41 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.872 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 38' ' ' ILE . 12.5 tt0 -108.97 143.18 38.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.123 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.978 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.9 pp -135.27 123.89 40.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.519 0.676 . . . . 0.0 111.574 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.409 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.73 104.98 0.25 Allowed Glycine 0 N--CA 1.452 -0.246 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.913 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.01 112.78 14.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.709 0.29 . . . . 0.0 110.339 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.9 171.13 14.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 0.0 111.467 -179.302 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 t -81.42 -16.44 52.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.007 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.34 131.47 56.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.869 0.366 . . . . 0.0 111.07 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.0 ttpt -58.14 -37.76 75.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.314 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -46.32 -32.54 3.2 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.094 0.473 . . . . 0.0 110.825 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.461 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 10.4 m120 -73.46 -48.83 30.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.28 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.79 -45.53 89.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.163 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.83 -51.1 71.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 71.5 m -59.19 -35.67 73.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.884 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.036 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.51 -51.92 31.33 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 121.815 0.817 . . . . 0.0 110.129 179.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -59.69 4.36 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.021 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.06 46.15 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.387 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt-85 -65.33 -39.9 93.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.88 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.18 -40.97 97.21 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.703 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 40.6 mttm -62.34 -46.85 86.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.664 178.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.53 -25.44 64.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.794 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.81 -22.49 53.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.368 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.19 23.92 5.61 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.73 149.0 52.58 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.255 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 31.2 t0 -92.25 74.23 5.37 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 121.056 -0.258 . . . . 0.0 110.821 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.67 140.51 30.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.088 0.471 . . . . 0.0 111.842 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.2 pt -132.66 149.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.085 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 91.7 t -102.78 135.8 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 0.0 110.969 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 pt -138.87 139.98 39.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.411 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 17.5 tp -93.3 105.32 17.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.142 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.703 ' O ' HD12 ' A' ' 9' ' ' LEU . 22.7 mt-10 -95.84 117.95 31.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.182 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.896 179.797 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.822 0.344 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.71 149.8 41.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -133.46 -48.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 34.3 p -80.19 114.41 19.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.943 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.6 p -174.42 174.47 2.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.919 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.84 -171.29 1.83 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 27.6 m -154.95 88.35 1.18 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.929 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 160.0 -155.08 26.17 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.7 mt -144.02 140.28 29.48 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.1 m-85 -101.4 106.45 17.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.312 -0.403 . . . . 0.0 109.987 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.8 mttm -126.03 155.7 41.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.477 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.007 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.25 142.77 19.18 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.211 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.301 179.839 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.416 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 3.6 tt0 -135.15 132.83 38.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 111.166 -179.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.539 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.09 -5.39 10.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -179.106 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.83 174.1 28.09 Favored Glycine 0 C--N 1.335 0.514 0 C-N-CA 119.209 -1.472 . . . . 0.0 114.562 179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.76 143.85 23.9 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.364 178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.572 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -147.37 151.45 36.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.374 . . . . 0.0 111.286 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.586 ' HG3' HD22 ' A' ' 45' ' ' LEU . 10.3 mttt -61.14 -15.57 34.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.385 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.4 t -105.8 128.4 60.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 121.032 0.444 . . . . 0.0 112.073 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.4 tmtt? -68.62 -42.59 77.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.481 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.44 -31.29 61.78 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.128 0.489 . . . . 0.0 109.95 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -77.94 -35.2 50.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.464 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.67 -21.19 61.84 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.12 -37.55 23.62 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.441 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -65.15 -36.11 83.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.23 0.538 . . . . 0.0 109.612 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.5 tp -69.07 -48.2 63.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.286 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.401 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.16 -25.93 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.064 0.459 . . . . 0.0 110.426 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.2 t -75.1 -40.63 59.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.36 -48.25 82.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.921 0.391 . . . . 0.0 110.709 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.92 -38.38 90.73 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.352 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -54.76 -36.41 64.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.323 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -50.99 64.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.513 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 9.6 mmpt? -62.2 -28.01 69.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.37 32.39 3.22 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.421 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -99.64 154.76 18.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.01 0.433 . . . . 0.0 110.751 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.39 92.58 7.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.751 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 98.0 p -79.95 156.06 27.41 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.036 0.446 . . . . 0.0 110.967 -178.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.632 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.65 141.47 7.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.772 -178.401 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.597 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 39.4 t -120.02 119.13 59.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.295 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.842 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -115.27 125.76 53.69 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.97 0.414 . . . . 0.0 110.394 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.842 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.2 tp -87.38 115.06 24.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.307 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.704 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.14 166.63 10.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.496 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.4 m-20 -55.35 65.96 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.9 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.46 -22.15 3.75 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 120.192 -1.004 . . . . 0.0 115.115 178.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.9 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.4 mt -142.67 161.6 37.64 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.189 0.994 . . . . 0.0 112.704 -178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.593 ' OH ' HD22 ' A' ' 41' ' ' LEU . 27.7 m-85 -111.1 131.95 54.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.273 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.713 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.7 149.3 27.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 111.79 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.797 ' HB ' HD23 ' A' ' 26' ' ' LEU . 61.8 t -123.0 104.36 14.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.683 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.632 ' HB3' HG23 ' A' ' 38' ' ' ILE . 4.8 tt0 -109.39 142.75 39.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.117 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.04 123.66 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-O 121.551 0.691 . . . . 0.0 111.592 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.91 103.91 0.26 Allowed Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.991 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.441 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -125.31 122.69 37.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.85 172.02 13.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.12 0.485 . . . . 0.0 111.567 -179.042 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.41 -16.97 47.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.005 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.12 130.8 56.57 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.827 0.346 . . . . 0.0 111.095 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.6 ttpt -57.95 -38.03 75.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.359 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -46.46 -31.31 2.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.967 0.413 . . . . 0.0 110.775 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.637 ' O ' HG22 ' A' ' 61' ' ' THR . 3.7 m-80 -74.07 -48.69 28.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.379 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.13 -44.63 94.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.155 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -59.07 -52.01 67.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.125 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.9 t -59.49 -34.15 72.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.925 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.007 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -51.88 28.58 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.701 0.763 . . . . 0.0 109.932 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.738 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.11 8.57 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.878 -177.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.43 -35.96 61.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.2 ttt180 -64.91 -39.48 93.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.682 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.91 -40.75 95.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.584 178.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 26.3 mttm -61.98 -47.34 85.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.706 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -68.78 -25.92 64.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.83 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.501 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.98 -21.9 54.0 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.388 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.92 23.91 5.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.484 -179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.573 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.01 148.89 52.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 28.1 t70 -92.37 74.58 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.926 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.687 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.13 142.0 29.81 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.104 0.478 . . . . 0.0 111.868 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.3 pt -133.77 151.47 33.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.881 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.521 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.7 t -104.68 134.6 45.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.978 0.418 . . . . 0.0 111.05 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.409 HD13 ' C ' ' A' ' 76' ' ' ILE . 0.0 OUTLIER -135.45 138.04 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.019 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.433 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.2 tp -93.25 107.4 19.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.238 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -89.08 103.88 16.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.004 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.905 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 tp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.953 0.406 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -142.18 -178.02 5.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.872 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 tttt -165.7 37.92 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -113.74 95.32 5.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.913 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.1 p -100.25 131.23 46.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.949 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.9 t -128.84 142.51 50.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.877 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.53 149.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.975 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.727 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 121.55 167.21 13.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.48 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 39.0 mt -143.49 138.57 29.32 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.511 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.3 m-85 -102.0 105.64 16.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.011 0.434 . . . . 0.0 110.109 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -124.99 156.36 38.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.437 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -110.5 138.14 39.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.318 179.865 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 14.0 tt0 -132.22 136.48 47.03 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.888 0.375 . . . . 0.0 111.167 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.66 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.02 -5.39 10.86 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -179.085 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.38 173.45 28.95 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 118.942 -1.599 . . . . 0.0 114.93 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.785 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.4 142.7 23.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.958 -0.621 . . . . 0.0 109.472 178.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.579 ' CE1' HD22 ' A' ' 26' ' ' LEU . 2.5 m-85 -146.16 149.23 33.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.878 0.37 . . . . 0.0 111.254 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 2.9 ttpt -60.81 -15.31 28.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.419 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -107.83 130.27 60.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-O 121.032 0.444 . . . . 0.0 111.637 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -69.43 -40.15 77.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.633 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -35.54 66.11 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.286 0.565 . . . . 0.0 109.619 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -73.99 -34.2 64.1 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.209 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.45 -19.74 61.51 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.761 179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.11 -35.49 25.58 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.474 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 t -67.68 -38.92 84.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.11 0.481 . . . . 0.0 109.724 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.728 HD23 ' HB ' ' A' ' 48' ' ' VAL . 20.4 tp -65.84 -53.29 41.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.379 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.35 -24.52 63.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -70.85 -42.39 70.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.537 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.724 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.89 -46.25 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.518 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.997 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.668 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.43 -37.18 67.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.149 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.94 -49.99 67.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.268 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.83 -29.04 70.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.423 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.14 32.92 2.89 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.539 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.758 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.9 m-85 -101.47 158.36 16.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.053 0.454 . . . . 0.0 110.544 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -87.27 94.86 9.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.634 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.607 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 35.0 p -80.07 157.38 26.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.845 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.59 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.91 137.43 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.752 -178.472 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.568 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.7 t -114.22 112.83 41.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.199 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.801 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -109.16 122.98 48.47 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.013 0.435 . . . . 0.0 110.921 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.801 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -87.85 115.0 25.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.709 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -101.44 166.45 10.72 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.499 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 6.5 t0 -55.08 65.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.885 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.01 -23.29 3.73 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 120.207 -0.997 . . . . 0.0 115.071 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.885 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.8 mt -141.21 161.77 37.07 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 118.277 1.038 . . . . 0.0 112.839 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.603 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.1 m-85 -112.66 134.31 54.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.671 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.38 148.84 28.57 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.156 0.503 . . . . 0.0 111.993 -179.558 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.728 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.9 t -121.89 99.01 6.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.307 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.59 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.2 tt0 -106.42 143.04 35.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.075 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.997 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.75 123.35 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 121.574 0.702 . . . . 0.0 111.513 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.429 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.76 110.12 0.3 Allowed Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 114.763 -1.108 . . . . 0.0 113.053 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -134.66 112.91 11.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.744 0.307 . . . . 0.0 110.52 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -132.5 174.53 10.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.039 0.447 . . . . 0.0 111.57 -179.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.3 t -84.73 -16.24 42.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.19 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.68 128.3 56.03 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.9 0.381 . . . . 0.0 111.044 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.511 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.0 -36.86 65.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.228 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -53.01 -30.23 34.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.439 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -72.18 -49.21 37.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.803 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.99 -41.2 97.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.002 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.61 -50.99 71.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.971 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 4.2 m -57.12 -37.64 72.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.811 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -50.1 53.82 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.737 0.78 . . . . 0.0 110.279 179.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.733 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.93 -60.64 3.06 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.166 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.74 59.15 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -63.88 -40.11 95.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.068 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.43 -40.5 95.87 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.69 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 33.3 mttm -62.03 -46.77 87.74 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -69.32 -26.37 64.68 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.826 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.61 -22.44 54.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.411 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.73 24.19 5.35 Favored Glycine 0 N--CA 1.449 -0.457 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.568 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.74 148.91 52.58 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 36.4 t70 -92.63 72.71 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.6 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.701 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.16 141.87 29.88 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.149 0.499 . . . . 0.0 111.745 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 7.6 pt -133.11 154.75 40.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.925 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.639 HG22 HG13 ' A' ' 12' ' ' VAL . 92.1 t -108.48 135.82 46.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.953 0.406 . . . . 0.0 110.881 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 pt -137.61 141.27 39.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.562 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.727 HD11 ' HA3' ' A' ' 8' ' ' GLY . 13.4 tp -101.06 102.98 14.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.172 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -105.37 138.45 41.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.16 -0.924 . . . . 0.0 110.846 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -116.05 124.29 50.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.868 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.26 84.84 6.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.0 p -76.82 156.93 31.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.19 99.38 1.49 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.942 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.02 79.38 1.9 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.869 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.4 171.88 19.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.531 ' H ' HD11 ' A' ' 77' ' ' LEU . . . -139.45 -117.69 1.49 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.509 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.605 HD13 ' HZ1' ' A' ' 11' ' ' LYS . 1.4 mt -143.68 138.36 28.86 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.9 m-85 -101.96 105.84 16.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.044 0.449 . . . . 0.0 110.214 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.605 ' HZ1' HD13 ' A' ' 9' ' ' LEU . 2.5 mttm -125.83 153.01 44.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.448 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.027 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.7 136.37 41.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.372 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.358 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -129.19 135.38 48.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.598 0.237 . . . . 0.0 111.021 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.573 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -6.0 10.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.789 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.41 172.09 29.4 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 118.834 -1.65 . . . . 0.0 114.885 178.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.55 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.92 138.1 19.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.849 -0.675 . . . . 0.0 109.486 178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -148.72 150.76 33.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 111.079 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 32.9 tttt -61.21 -12.65 13.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.068 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -109.13 129.9 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 111.907 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.7 -38.35 67.55 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.592 179.811 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.8 -34.86 63.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.328 0.585 . . . . 0.0 109.634 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -75.4 -31.87 60.56 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.178 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.36 -18.86 60.62 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.93 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -84.71 -38.18 20.04 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.634 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -68.43 -35.73 78.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.293 0.568 . . . . 0.0 109.588 179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.829 HD12 ' ND2' ' A' ' 29' ' ' ASN . 56.7 tp -68.14 -51.99 39.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.119 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.97 -24.43 62.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.408 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.7 m -71.32 -41.27 70.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.5 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.829 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.64 -46.93 87.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.446 179.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.949 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -59.67 -41.45 90.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.556 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -55.63 -36.83 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.233 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.38 -51.19 63.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.393 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.6 mmpt? -62.73 -28.54 70.03 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.91 32.8 2.98 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.513 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.783 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -101.16 157.62 16.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.927 0.394 . . . . 0.0 110.809 179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.41 92.23 8.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.656 ' HA ' HG22 ' A' ' 50' ' ' ILE . 77.3 p -80.35 156.66 26.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.142 0.496 . . . . 0.0 111.033 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.89 141.86 5.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.527 -178.84 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.559 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.0 t -114.65 111.68 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.175 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.801 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -107.29 124.78 50.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.918 0.39 . . . . 0.0 110.511 179.752 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.801 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.1 tp -87.11 112.37 21.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.043 0.449 . . . . 0.0 110.914 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.693 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -91.67 166.11 12.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.326 178.369 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.477 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.9 OUTLIER -57.43 68.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.844 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.94 -24.42 3.45 Favored Glycine 0 C--N 1.337 0.616 0 C-N-CA 120.286 -0.959 . . . . 0.0 114.507 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.844 HD23 ' O ' ' A' ' 44' ' ' GLY . 21.2 mt -143.47 170.83 15.06 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 117.799 0.8 . . . . 0.0 112.32 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.536 ' OH ' HD22 ' A' ' 41' ' ' LEU . 24.6 m-85 -115.68 139.58 50.0 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.303 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -122.23 158.89 28.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.652 HG21 ' HB3' ' A' ' 26' ' ' LEU . 93.0 t -122.99 114.08 40.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.296 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.572 ' HB3' HG23 ' A' ' 38' ' ' ILE . 23.2 tt0 -112.45 137.52 50.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.797 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.949 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.54 123.97 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 121.625 0.726 . . . . 0.0 111.488 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.55 102.35 0.21 Allowed Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.085 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -126.11 120.99 31.6 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -141.04 174.32 10.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.153 0.501 . . . . 0.0 111.589 -179.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.1 m -84.72 -15.76 44.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.001 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -112.42 128.08 56.21 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.79 0.329 . . . . 0.0 111.098 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -56.6 -35.18 67.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.27 -179.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -51.86 -31.5 28.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.85 0.357 . . . . 0.0 110.98 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 9.9 m-80 -71.98 -49.74 34.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.577 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.95 -42.24 93.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -60.17 -50.93 71.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.819 0.342 . . . . 0.0 110.793 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 7.8 m -58.54 -37.12 75.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.824 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.027 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.52 -51.27 44.86 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.752 0.787 . . . . 0.0 110.154 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.39 -59.97 3.97 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.091 -177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.31 -36.62 43.51 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.382 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -65.69 -39.53 91.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.836 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.0 -41.88 94.97 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.562 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.0 mmmm -61.79 -46.8 87.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.795 178.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -69.85 -25.55 63.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.747 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.469 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.38 -22.43 54.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.381 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.94 23.39 5.59 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.446 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.39 147.6 52.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.452 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 33.8 t70 -91.02 73.36 6.41 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.675 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.6 140.55 30.5 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.105 0.478 . . . . 0.0 111.871 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.9 pt -132.53 151.15 34.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.833 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.504 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.4 t -103.95 135.72 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.858 0.361 . . . . 0.0 110.982 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.0 pt -136.36 139.57 45.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.249 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.531 HD11 ' H ' ' A' ' 8' ' ' GLY . 16.6 tp -96.09 106.62 18.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.325 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -93.97 109.04 20.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.873 0.368 . . . . 0.0 111.032 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.959 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.794 0.331 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -135.88 117.45 14.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.822 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -114.85 -40.69 3.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.961 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 t -130.78 147.42 52.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.917 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.61 76.36 0.38 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 73.1 m -88.94 -176.41 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.957 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.5 m 62.3 39.26 12.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.84 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -103.88 -131.06 7.09 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.333 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 5.4 mp -143.95 139.29 29.03 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.52 ' CE1' HD13 ' A' ' 77' ' ' LEU . 41.5 m-85 -101.94 105.72 16.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.035 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.49 152.98 44.24 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.35 137.72 35.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.131 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -132.96 134.47 44.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.698 0.285 . . . . 0.0 111.253 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.581 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -105.86 -4.79 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.96 174.7 29.01 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 119.135 -1.507 . . . . 0.0 114.766 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.76 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.19 141.78 22.63 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.621 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -147.87 149.8 32.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.025 0.441 . . . . 0.0 111.351 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 8.1 tttt -61.58 -13.74 24.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -106.58 126.18 62.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.794 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.12 -40.57 82.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.469 179.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.49 -32.27 64.85 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.263 0.554 . . . . 0.0 109.9 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -77.54 -34.01 54.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.395 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.506 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.92 -19.54 60.66 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.849 179.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.43 -37.49 21.37 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.562 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -38.63 88.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.297 0.57 . . . . 0.0 109.63 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 40.5 tp -66.09 -51.48 57.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.188 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.524 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.19 -23.93 57.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.543 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.1 m -73.0 -41.32 64.42 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.677 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.27 -47.16 86.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.604 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.68 -40.61 95.58 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.578 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -55.14 -37.24 66.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.283 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.76 -49.93 69.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.27 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -62.39 -28.49 69.81 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.93 31.43 3.36 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.555 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.781 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.1 156.07 17.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 120.92 0.39 . . . . 0.0 110.799 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.88 93.13 8.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.696 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.0 p -80.28 157.22 26.49 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 121.128 0.489 . . . . 0.0 110.926 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -156.95 139.66 6.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.705 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.5 t -116.41 115.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.219 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.797 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -110.41 124.29 51.46 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.865 0.364 . . . . 0.0 110.812 179.815 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.866 HD22 ' OH ' ' A' ' 46' ' ' TYR . 5.0 tp -88.74 114.73 25.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.176 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.68 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.45 166.92 10.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.146 178.236 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.492 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 14.1 t0 -53.72 65.3 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.909 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.19 -23.07 3.71 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 120.218 -0.991 . . . . 0.0 115.295 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.0 mt -141.98 163.51 32.69 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.34 1.07 . . . . 0.0 113.0 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.866 ' OH ' HD22 ' A' ' 41' ' ' LEU . 29.6 m-85 -112.22 134.44 53.76 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.648 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.76 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.55 148.65 28.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.179 0.514 . . . . 0.0 111.84 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.789 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.8 t -120.54 100.41 9.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.393 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.556 ' HB3' HG23 ' A' ' 38' ' ' ILE . 31.5 tt0 -108.97 142.39 39.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.319 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -136.31 122.98 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-O 121.538 0.685 . . . . 0.0 111.657 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.16 107.67 0.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.912 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.12 118.59 21.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.651 0.262 . . . . 0.0 110.428 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -138.31 172.79 12.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 111.48 -179.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.6 t -84.15 -15.49 46.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.092 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.29 128.81 56.38 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.0 tmtm? -55.65 -35.58 66.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.275 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -53.17 -29.96 34.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.455 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 26.4 m120 -71.56 -49.85 36.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.721 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.515 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.99 -40.87 95.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.061 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -60.2 -50.96 71.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.741 0.305 . . . . 0.0 110.914 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 13.6 m -58.59 -37.46 75.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.58 -51.03 47.03 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-O 121.732 0.777 . . . . 0.0 110.085 179.449 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.36 -59.99 3.95 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.093 -177.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.84 -36.05 46.77 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.43 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.98 -38.74 89.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.871 178.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.14 96.28 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.662 178.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.8 OUTLIER -62.27 -46.25 89.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.722 178.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.2 -25.54 63.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.694 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.481 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.45 -23.64 53.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.35 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.9 23.38 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.552 -179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.549 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.67 148.26 52.44 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 45.6 t0 -91.79 74.03 5.75 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.644 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.684 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.07 142.29 30.52 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.066 0.46 . . . . 0.0 111.956 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.4 pt -133.12 151.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.8 179.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.515 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.5 t -105.42 135.41 43.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.393 . . . . 0.0 111.125 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 30.1 pt -135.51 138.95 47.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.221 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.52 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.1 tp -100.61 104.64 15.98 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.292 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -94.27 113.58 25.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.03 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.317 -0.849 . . . . 0.0 110.859 -179.944 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.802 0.334 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -67.19 -35.78 80.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.991 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -138.26 70.64 1.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.966 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.439 HG22 ' H ' ' A' ' 5' ' ' SER . 0.2 OUTLIER 60.05 174.5 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.898 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.439 ' H ' HG22 ' A' ' 4' ' ' THR . 29.4 t -108.8 137.13 47.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.986 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.29 99.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.937 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.6 t -92.98 -57.6 2.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.803 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.766 ' O ' HD22 ' A' ' 9' ' ' LEU . . . 83.18 110.86 0.51 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.57 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.766 HD22 ' O ' ' A' ' 8' ' ' GLY . 3.4 mm? -141.68 137.86 32.05 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -100.93 106.77 18.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.195 0.522 . . . . 0.0 110.17 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.406 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 6.7 mttm -125.85 152.97 44.79 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.403 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.032 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.18 140.57 22.81 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.247 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.209 179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.421 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 42.2 tt0 -132.92 131.81 41.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.717 0.294 . . . . 0.0 111.281 -179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.569 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.02 -5.57 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -179.284 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.19 172.28 28.31 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 119.104 -1.522 . . . . 0.0 114.634 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.763 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 141.07 22.09 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 114.884 -0.658 . . . . 0.0 109.254 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.581 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.3 m-85 -146.63 150.28 35.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.913 0.387 . . . . 0.0 111.357 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.37 -13.81 22.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.424 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -106.45 128.5 60.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.046 0.451 . . . . 0.0 111.989 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 7.2 tmtt? -69.34 -41.13 77.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.487 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.74 -31.06 64.18 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.171 0.51 . . . . 0.0 109.924 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -78.07 -35.1 49.9 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.335 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.56 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.32 -22.99 61.85 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.772 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -38.66 26.85 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.531 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.0 t -63.67 -37.73 88.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.228 0.537 . . . . 0.0 109.653 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.2 tp -67.31 -46.03 74.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.198 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.417 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -59.39 -26.59 65.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.462 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.74 -41.05 60.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.21 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.957 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.1 -48.07 82.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.889 0.376 . . . . 0.0 110.695 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -63.2 -38.2 90.22 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.348 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -54.85 -36.65 65.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.462 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.01 -51.55 56.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.557 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 7.5 mmtm -62.64 -28.13 69.7 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.78 34.47 2.81 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.461 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -100.61 155.41 17.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.975 0.416 . . . . 0.0 110.85 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -83.46 94.34 7.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.824 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.574 ' HA ' HG22 ' A' ' 50' ' ' ILE . 80.1 p -79.96 155.2 27.79 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.092 0.472 . . . . 0.0 110.971 -178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.653 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.9 139.95 8.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.699 -178.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.63 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.0 t -118.59 116.25 50.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.391 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.798 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -110.62 124.12 51.28 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 110.724 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.798 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.4 tp -88.34 114.83 25.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.228 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.694 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -99.96 166.63 10.96 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 177.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.9 OUTLIER -55.71 66.67 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.904 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 133.82 -22.92 3.8 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 120.02 -1.086 . . . . 0.0 115.004 178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.904 HD23 ' O ' ' A' ' 44' ' ' GLY . 29.3 mt -141.72 161.78 37.09 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.193 0.996 . . . . 0.0 112.91 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.658 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.7 m-85 -112.78 134.4 54.32 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.622 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.763 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.14 150.59 27.02 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 111.541 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.824 ' HB ' HD23 ' A' ' 26' ' ' LEU . 98.3 t -124.36 102.0 10.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.633 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.6 tt0 -106.84 142.86 35.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.047 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.62 123.16 41.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.472 0.654 . . . . 0.0 111.488 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.522 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.22 105.52 0.23 Allowed Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.894 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.57 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.88 122.38 32.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.659 0.266 . . . . 0.0 110.397 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -140.74 171.62 13.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.203 0.525 . . . . 0.0 111.454 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -17.25 51.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.866 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.0 t -113.78 130.27 56.47 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.865 0.365 . . . . 0.0 110.954 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 13.3 ttpt -57.13 -37.47 72.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.398 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -47.11 -31.16 3.25 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.966 0.412 . . . . 0.0 110.698 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' CB ' ' CD1' ' A' ' 53' ' ' PHE . 19.8 m120 -73.28 -49.99 24.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.235 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.556 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.73 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.12 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.24 -51.15 71.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.844 0.355 . . . . 0.0 111.009 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 28.3 m -58.84 -35.21 72.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.918 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.032 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.33 -51.95 26.33 Favored 'General case' 0 CA--C 1.505 -0.762 0 CA-C-O 121.747 0.785 . . . . 0.0 110.187 179.435 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.744 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.99 -57.9 9.29 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.231 -1.35 . . . . 0.0 111.013 -178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.36 -37.39 62.35 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.429 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.4 ttt-85 -64.47 -38.23 90.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.639 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.27 -41.15 94.49 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.624 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.563 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.8 mttm -62.17 -46.94 86.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.691 178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.29 -25.44 64.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.686 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.468 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.16 -22.54 52.37 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.36 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 23.59 5.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.584 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.563 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.36 148.93 52.72 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.447 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.5 74.74 5.16 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.025 -0.27 . . . . 0.0 110.807 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.47 141.83 29.65 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.062 0.458 . . . . 0.0 111.95 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.587 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -133.27 152.11 34.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.02 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.556 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.9 t -104.78 136.35 38.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.798 0.333 . . . . 0.0 111.085 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.628 HD12 ' HG2' ' A' ' 78' ' ' GLU . 1.0 OUTLIER -140.3 141.84 32.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.354 -179.893 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.5 tp -90.58 110.76 21.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.196 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.628 ' HG2' HD12 ' A' ' 76' ' ' ILE . 4.6 mm-40 -93.22 143.08 26.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.023 0.44 . . . . 0.0 111.172 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.158 0 CA-C-O 118.108 -0.948 . . . . 0.0 110.832 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.883 0.373 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.9 -52.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 138.87 31.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.887 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.48 176.1 8.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.91 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.5 m -141.14 -49.18 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.958 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.7 m -127.74 162.53 26.38 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.902 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 m -83.9 163.19 20.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.928 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 61.39 153.65 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.509 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.42 ' H ' HD12 ' A' ' 77' ' ' LEU . 4.2 mp -143.97 140.14 29.48 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.513 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.6 m-85 -101.43 106.62 17.77 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.037 0.446 . . . . 0.0 109.997 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.49 155.45 38.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.429 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.001 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.78 142.92 18.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.284 179.876 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -133.91 132.74 40.62 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.581 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.07 -5.97 9.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.76 173.79 29.8 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 118.877 -1.63 . . . . 0.0 114.893 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.547 ' HB1' ' HG3' ' A' ' 47' ' ' LYS . . . -151.01 135.91 17.36 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.962 -0.619 . . . . 0.0 109.71 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.633 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.0 m-85 -145.01 149.37 35.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.8 0.334 . . . . 0.0 111.08 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 4.7 ttpm? -60.78 -14.13 19.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.937 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.9 t -106.76 127.99 61.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.062 0.458 . . . . 0.0 112.107 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -69.64 -42.27 74.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.579 179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.11 -32.52 47.83 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.177 0.513 . . . . 0.0 109.815 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -76.94 -32.58 57.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.282 178.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.501 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.09 -20.63 60.2 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.891 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.58 -39.13 20.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 110.747 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.8 t -66.61 -37.13 84.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 0.0 109.659 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 55.8 tp -66.47 -52.1 49.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.182 179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.654 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.03 -24.45 58.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.441 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.1 t -71.83 -41.74 67.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.556 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -58.88 -47.55 84.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.571 179.599 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.954 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.09 -41.41 92.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.648 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.15 -37.02 66.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.234 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.8 -51.12 64.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.341 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.43 -28.43 69.79 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.73 31.69 3.11 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.687 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.79 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -101.01 158.0 16.33 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 110.833 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 94.9 9.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.751 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.654 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 47.5 p -80.29 156.83 26.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.227 0.537 . . . . 0.0 110.982 -178.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.63 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -155.97 137.13 5.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.659 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.501 HG13 ' HB1' ' A' ' 23' ' ' ALA . 39.3 t -113.98 112.67 41.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.195 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.785 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -108.09 124.24 49.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.934 0.397 . . . . 0.0 110.614 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.785 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.1 tp -84.99 110.48 18.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.084 0.469 . . . . 0.0 111.211 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.639 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -92.1 166.48 12.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.471 178.675 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.57 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.9 m-20 -57.24 66.08 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.818 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 126.29 -12.02 7.16 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 120.429 -0.891 . . . . 0.0 114.4 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.818 HD23 ' O ' ' A' ' 44' ' ' GLY . 33.5 mt -144.6 158.18 43.88 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 117.543 0.672 . . . . 0.0 112.561 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.603 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.8 m-85 -111.89 136.31 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.159 177.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.547 ' HG3' ' HB1' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.55 156.53 31.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.12 0.486 . . . . 0.0 111.613 -179.342 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.689 ' HB ' HD23 ' A' ' 26' ' ' LEU . 87.9 t -125.43 113.96 37.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.48 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.63 ' HB3' HG23 ' A' ' 38' ' ' ILE . 3.3 tt0 -111.93 141.32 45.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.954 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.1 123.44 39.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.515 0.674 . . . . 0.0 111.575 179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.29 107.59 0.28 Allowed Glycine 0 N--CA 1.452 -0.26 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.823 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.495 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -129.37 118.37 22.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.688 0.28 . . . . 0.0 110.553 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.03 174.21 10.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.011 0.434 . . . . 0.0 111.551 -179.402 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 54.4 p -83.57 -17.04 43.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.093 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -112.55 128.34 56.33 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.85 0.357 . . . . 0.0 111.174 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.513 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.2 tmtp? -55.53 -34.74 64.96 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.082 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -52.23 -32.0 34.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.045 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.453 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 35.9 m120 -70.89 -49.6 44.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.617 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.46 -40.54 82.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.012 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -61.66 -49.98 74.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.761 0.315 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 1.1 m -59.48 -34.76 72.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.837 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.001 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.01 -51.52 24.95 Favored 'General case' 0 CA--C 1.503 -0.843 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.726 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.09 -58.25 8.03 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.922 -177.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.67 -37.26 63.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.662 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 61' ' ' THR . 5.5 ttt180 -64.19 -38.73 92.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.777 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.79 -41.05 96.12 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.67 -46.38 89.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 178.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -69.79 -26.09 64.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.803 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.461 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.76 -22.85 53.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.404 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.25 23.59 5.42 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.466 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.566 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.72 148.8 52.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.4 t70 -92.34 73.53 5.29 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.675 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.707 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.43 142.79 28.99 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.116 0.484 . . . . 0.0 111.985 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 4.9 pt -134.69 162.01 39.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.617 HG22 ' HB1' ' A' ' 59' ' ' ALA . 90.0 t -112.29 137.03 46.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.8 pt -139.97 140.18 36.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.323 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.644 HD11 ' HA3' ' A' ' 8' ' ' GLY . 11.6 tp -92.03 107.42 19.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.306 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -100.82 131.07 46.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.181 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.833 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.561 ' O ' HD12 ' A' ' 1' ' ' LEU . 1.8 pp . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.81 94.46 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.929 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.0 tptp -66.19 165.91 12.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.96 163.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.885 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.77 -35.82 6.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.919 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.42 -175.93 4.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.004 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.57 -167.51 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.516 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -78.05 -174.05 42.29 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.572 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 93.0 mt -143.84 140.38 29.8 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -100.83 106.63 18.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.074 0.464 . . . . 0.0 110.069 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -126.31 156.77 39.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.52 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.045 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.92 138.99 31.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.316 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.145 179.761 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -131.22 133.75 45.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.717 0.294 . . . . 0.0 111.158 -179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.518 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.55 -5.64 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -178.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.41 175.21 29.08 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.055 -1.545 . . . . 0.0 114.558 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.623 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.62 142.54 23.0 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.995 -0.603 . . . . 0.0 109.426 178.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.611 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.8 m-85 -147.53 150.13 33.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.878 0.37 . . . . 0.0 111.346 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 29.3 pttt -61.72 -13.63 24.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.489 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -107.27 127.04 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.176 0.512 . . . . 0.0 111.959 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -68.09 -42.12 80.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.574 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.23 -31.69 63.77 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.148 0.499 . . . . 0.0 110.02 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -78.22 -34.94 49.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.5 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.39 -19.21 61.04 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.881 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.95 -37.66 20.24 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.496 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -37.73 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 59.6 tp -66.26 -51.63 55.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.127 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -57.67 -23.87 53.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.534 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.09 -41.15 64.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.63 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.08 -46.98 86.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.965 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.1 -40.41 95.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.632 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -55.28 -37.11 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.275 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.17 -50.81 66.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.376 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.3 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.07 32.3 3.08 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.537 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.78 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.1 m-85 -100.55 155.8 17.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.949 0.404 . . . . 0.0 110.858 179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.44 92.41 8.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.697 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.632 ' HA ' HG22 ' A' ' 50' ' ' ILE . 96.4 p -80.12 157.4 26.65 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.175 0.512 . . . . 0.0 110.894 -178.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.85 142.35 6.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.739 -178.431 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.621 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -121.8 122.41 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.272 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.846 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -114.79 125.24 53.47 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.424 179.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.846 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -85.2 114.05 22.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.46 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.628 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -101.05 167.18 10.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.089 178.244 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.561 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.2 m-20 -56.02 64.0 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.818 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 127.94 -12.4 6.49 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 120.341 -0.933 . . . . 0.0 114.654 178.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.818 HD23 ' O ' ' A' ' 44' ' ' GLY . 18.0 mt -144.61 152.86 41.12 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.015 0.907 . . . . 0.0 112.908 -179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.632 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.8 m-85 -109.34 129.69 55.52 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.407 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -103.76 147.03 27.75 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.917 0.389 . . . . 0.0 111.831 -179.256 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.755 ' CB ' HD23 ' A' ' 26' ' ' LEU . 98.7 t -120.96 105.2 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.737 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 15.3 tt0 -111.86 142.04 44.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.416 -179.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.965 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.38 123.78 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-O 121.588 0.708 . . . . 0.0 111.561 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.402 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 81.08 106.32 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.872 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -129.11 117.45 20.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.666 0.269 . . . . 0.0 110.492 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -137.09 170.11 16.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.138 0.494 . . . . 0.0 111.422 -179.334 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -17.08 53.44 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.944 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.47 131.71 56.52 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.95 0.405 . . . . 0.0 110.947 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.498 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 5.0 ttpt -57.63 -37.96 74.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.376 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -46.04 -32.98 3.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.049 0.452 . . . . 0.0 110.854 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.457 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 13.2 m120 -71.91 -49.2 39.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.411 179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.655 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -58.06 -44.57 87.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.084 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.29 -52.31 66.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.76 0.314 . . . . 0.0 111.209 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.47 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.04 -34.58 72.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.103 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.045 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.3 -51.9 26.86 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.718 0.77 . . . . 0.0 110.135 179.429 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.5 -59.13 5.11 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.029 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.72 -37.21 50.01 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.276 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.2 OUTLIER -65.0 -38.25 90.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.784 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.34 -41.91 93.44 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.762 178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.9 mttm -62.09 -46.83 87.35 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.638 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.58 -25.29 63.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.811 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.2 -23.3 51.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.336 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.64 23.36 5.4 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.412 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.3 m-85 -131.18 149.18 52.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.2 t70 -92.98 74.59 4.78 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.99 -0.284 . . . . 0.0 110.662 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.68 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.5 143.41 28.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.135 0.493 . . . . 0.0 111.778 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.5 pt -134.69 151.46 31.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.837 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.655 HG22 ' HB1' ' A' ' 59' ' ' ALA . 88.1 t -103.61 135.78 39.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt -138.71 140.45 39.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.26 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.516 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.9 tp -94.11 106.05 18.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.16 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -99.08 117.87 34.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.232 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.86 179.93 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.804 0.335 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.68 90.97 2.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.5 pttt -164.93 159.56 18.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.865 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.8 p 50.52 -177.92 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 79.2 p -102.83 -75.12 0.61 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.5 101.48 0.25 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.931 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.92 131.53 19.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.946 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.81 125.03 3.18 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.537 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 6.7 mt -144.27 141.51 29.87 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.516 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.6 m-85 -101.86 106.79 17.81 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.142 0.496 . . . . 0.0 109.874 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.415 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 34.9 mttm -125.05 154.41 41.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.649 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.054 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -108.33 137.02 42.06 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.313 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.205 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -129.6 135.46 48.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.651 0.263 . . . . 0.0 111.008 -179.391 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.552 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.23 -5.03 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -178.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.64 173.52 28.22 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 118.964 -1.589 . . . . 0.0 114.559 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.612 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.87 143.49 23.57 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.861 -0.669 . . . . 0.0 109.29 178.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.565 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.9 m-85 -150.03 148.29 28.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.89 0.376 . . . . 0.0 111.393 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 12.1 pttt -60.8 -13.88 18.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.609 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.08 124.46 61.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.158 0.504 . . . . 0.0 112.116 -179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.8 OUTLIER -64.93 -44.69 88.68 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.602 179.634 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.65 -31.77 48.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.15 0.5 . . . . 0.0 109.856 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.92 -35.77 50.17 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.593 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.05 -21.51 61.52 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -37.72 24.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.629 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -64.46 -37.18 86.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 109.626 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.977 HD12 ' OD1' ' A' ' 29' ' ' ASN . 26.8 tp -67.41 -50.8 57.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.331 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.579 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.37 -26.39 52.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.083 0.468 . . . . 0.0 110.652 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.34 -41.04 61.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.084 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.977 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.45 -48.92 79.79 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.962 0.41 . . . . 0.0 110.772 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.948 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.14 -39.32 89.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -54.36 -37.15 64.61 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.16 -50.54 64.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.429 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpp? -62.41 -28.37 69.74 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.46 33.83 2.82 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.501 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.703 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.2 m-85 -102.05 159.89 14.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.989 0.423 . . . . 0.0 110.626 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -87.56 94.06 9.61 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.773 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.602 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.42 157.91 26.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.007 0.432 . . . . 0.0 110.789 -178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.481 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.42 140.12 6.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.007 -178.463 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.59 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 30.1 t -118.99 118.79 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.845 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -114.75 125.9 54.23 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.002 0.429 . . . . 0.0 110.572 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.845 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.1 tp -86.14 114.31 22.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.209 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.66 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -102.14 167.14 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.095 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.569 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.6 p-10 -56.18 63.8 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.834 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 128.83 -13.77 6.07 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.367 -0.92 . . . . 0.0 114.778 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.834 HD23 ' O ' ' A' ' 44' ' ' GLY . 12.4 mt -144.49 151.97 39.92 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.072 0.936 . . . . 0.0 113.197 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.639 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.2 m-85 -108.2 128.35 54.64 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.312 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.612 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -102.72 146.5 28.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.229 0.537 . . . . 0.0 111.872 -178.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 88.4 t -121.79 103.4 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.621 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' HB3' HG23 ' A' ' 38' ' ' ILE . 9.1 tt0 -110.62 143.64 40.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.634 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.948 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.18 123.1 32.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.58 0.705 . . . . 0.0 111.618 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.66 111.78 0.3 Allowed Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.145 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.415 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.99 112.72 11.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.248 . . . . 0.0 110.371 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -129.65 173.77 10.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.457 . . . . 0.0 111.522 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 m -83.81 -17.66 40.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.967 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.8 131.94 56.04 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 120.873 0.368 . . . . 0.0 111.078 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpp -58.06 -39.62 78.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.271 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -46.07 -32.52 2.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.96 0.409 . . . . 0.0 110.761 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.444 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 71.0 m-80 -70.98 -49.64 43.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.367 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.711 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.49 -41.02 75.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.04 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -61.45 -49.26 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.87 0.367 . . . . 0.0 110.902 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -60.92 -34.93 75.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.855 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.054 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.88 -53.05 16.55 Favored 'General case' 0 CA--C 1.504 -0.819 0 CA-C-O 121.877 0.846 . . . . 0.0 110.047 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.758 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.71 -58.83 5.99 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.141 -1.391 . . . . 0.0 110.853 -177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.86 -37.77 53.43 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.413 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.8 ttt180 -64.86 -39.41 93.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.752 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.03 -41.76 94.96 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.603 179.123 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 29.9 mttt -62.05 -47.14 86.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.695 178.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -69.14 -25.59 64.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.723 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.68 -22.22 54.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.271 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.85 23.74 5.78 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.58 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -129.99 148.58 51.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.392 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.7 t0 -92.06 73.85 5.53 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.926 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.01 140.57 30.93 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.05 0.452 . . . . 0.0 111.913 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 20.7 pt -133.34 152.11 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.922 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.711 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.6 t -103.17 138.18 28.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.898 0.38 . . . . 0.0 111.156 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 pt -141.44 138.78 32.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.351 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.9 tp -95.57 105.8 17.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.172 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -129.04 151.76 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 68.2 m . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.905 179.88 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.453 HD23 ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.809 0.337 . . . . 0.0 111.193 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.453 ' N ' HD23 ' A' ' 1' ' ' LEU . 5.2 mtmp? -103.51 81.64 1.94 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.15 -31.33 43.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 t -124.51 164.93 18.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.98 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 51.0 m -66.63 -29.64 69.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.961 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.6 t 63.85 126.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.824 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -174.77 -41.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.84 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.44 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -172.43 -167.09 31.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.381 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 85.4 mt -143.84 139.02 29.07 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.5 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.3 m-85 -101.28 106.38 17.57 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.064 0.459 . . . . 0.0 109.971 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.12 154.3 41.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.458 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.059 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.58 140.5 24.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.19 179.892 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -133.37 135.29 44.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 111.243 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.561 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -108.06 -5.43 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.33 174.23 28.8 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 118.968 -1.587 . . . . 0.0 114.646 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.765 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.21 141.42 22.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.939 -0.631 . . . . 0.0 109.389 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.638 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.8 m-85 -147.27 149.54 33.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.973 0.416 . . . . 0.0 111.377 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.54 -12.83 16.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.553 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.09 125.93 63.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 121.078 0.466 . . . . 0.0 112.072 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 10.4 tmtt? -67.02 -42.02 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.414 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.63 -31.32 62.19 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.178 0.514 . . . . 0.0 109.909 179.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -78.36 -33.96 48.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.473 178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.07 -20.1 60.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -37.54 21.33 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -38.41 87.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.326 0.584 . . . . 0.0 109.512 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.815 HD12 ' ND2' ' A' ' 29' ' ' ASN . 41.8 tp -66.26 -51.49 57.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.21 179.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -57.93 -24.0 55.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.579 178.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t -72.92 -41.41 64.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.572 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.815 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.23 -47.03 86.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.568 179.834 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.97 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.58 -40.66 95.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.507 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -55.11 -37.26 66.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.312 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.28 67.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.171 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.36 -28.49 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.656 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.04 31.5 3.31 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.416 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.18 156.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 120.984 0.421 . . . . 0.0 110.777 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -85.68 93.33 8.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.728 179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.617 ' HA ' HG22 ' A' ' 50' ' ' ILE . 81.7 p -80.43 157.6 26.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.23 0.538 . . . . 0.0 110.873 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.34 140.1 6.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.754 -178.543 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.15 116.31 51.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.272 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.805 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -110.27 123.59 50.08 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.844 0.354 . . . . 0.0 110.697 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.805 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -88.02 115.37 25.45 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.148 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.711 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -101.49 166.69 10.59 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 177.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 8.9 t0 -55.26 65.68 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -178.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.907 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.31 -23.62 3.64 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.202 -0.999 . . . . 0.0 115.156 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.907 HD23 ' O ' ' A' ' 44' ' ' GLY . 25.5 mt -141.01 161.15 38.53 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 118.215 1.008 . . . . 0.0 112.96 -178.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.611 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.9 m-85 -112.23 133.76 54.16 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.723 178.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.765 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.79 148.78 28.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.056 0.455 . . . . 0.0 111.733 -179.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.796 ' HB ' HD23 ' A' ' 26' ' ' LEU . 90.5 t -121.31 100.9 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.653 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -107.51 142.1 37.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.162 -179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.97 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -136.0 123.59 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-O 121.653 0.74 . . . . 0.0 111.658 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.407 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.92 105.58 0.26 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.701 -1.136 . . . . 0.0 113.002 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.61 112.68 14.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.754 0.311 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.28 171.69 12.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.066 0.46 . . . . 0.0 111.62 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.77 -17.45 50.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.8 t -114.44 132.67 56.17 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.869 0.366 . . . . 0.0 111.018 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.5 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.8 ttpp -58.24 -37.68 75.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.336 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -46.47 -32.13 3.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.109 0.48 . . . . 0.0 110.825 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.447 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 30.5 m120 -72.57 -49.58 31.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.35 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.688 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.46 -44.74 85.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.157 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -59.71 -50.35 74.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.826 0.346 . . . . 0.0 110.987 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.44 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.0 m -60.17 -35.23 74.88 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.806 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.059 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.03 -52.01 27.54 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-O 121.811 0.815 . . . . 0.0 109.989 179.493 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.747 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.6 -58.72 6.38 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.179 -1.373 . . . . 0.0 111.066 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.27 -36.42 52.7 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.385 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt180 -65.82 -39.17 90.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.702 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.99 -41.16 97.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.574 178.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 36.8 mttm -61.88 -46.07 91.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.751 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -70.16 -25.48 63.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.806 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.482 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.07 -23.11 52.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.239 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.15 24.0 5.29 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.407 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.553 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.31 147.82 52.62 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 13.0 t70 -92.31 74.44 5.32 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.689 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.668 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.89 142.71 29.51 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.105 0.479 . . . . 0.0 111.908 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -133.94 153.04 35.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.855 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.688 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.0 t -102.83 136.06 37.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.955 0.407 . . . . 0.0 111.123 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.3 tt -136.27 135.05 49.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.106 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.475 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.0 tp -96.18 105.65 17.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.251 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -99.31 125.51 44.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.029 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.882 179.953 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.0 tp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.936 0.398 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -144.51 31.43 1.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.934 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -138.64 -47.2 0.5 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.958 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.6 p -94.6 44.49 1.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.81 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -44.93 82.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.906 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.2 m -144.78 102.41 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.864 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.3 m -126.74 79.27 1.86 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.031 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.09 -136.93 5.47 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.394 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 0.7 OUTLIER -144.05 139.2 28.82 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 39.8 m-85 -101.33 106.66 17.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.078 0.466 . . . . 0.0 110.097 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -124.84 154.06 41.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.462 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.047 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.57 139.73 27.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 120.776 -0.37 . . . . 0.0 110.33 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -131.79 133.09 44.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.733 0.301 . . . . 0.0 111.058 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.58 -5.46 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -179.048 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.57 175.45 28.51 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 119.123 -1.513 . . . . 0.0 114.553 178.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.741 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.81 145.36 24.9 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 114.946 -0.627 . . . . 0.0 109.342 178.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.577 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.4 m-85 -149.11 153.1 37.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.123 0.487 . . . . 0.0 111.531 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HG2' HD23 ' A' ' 45' ' ' LEU . 20.4 mttp -61.42 -16.78 50.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.255 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -106.93 129.25 60.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.071 0.462 . . . . 0.0 112.182 -179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.6 OUTLIER -70.57 -39.89 73.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.316 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.03 -32.84 66.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.249 0.547 . . . . 0.0 109.9 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -76.58 -34.66 58.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.254 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.435 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.65 -18.47 61.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.826 179.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.49 -37.7 21.01 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.513 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.6 t -66.02 -38.04 87.43 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 ' ND2' ' A' ' 29' ' ' ASN . 57.3 tp -65.6 -51.34 60.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.058 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.635 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.04 -23.91 56.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.493 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.0 t -72.8 -41.25 65.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.545 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.823 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.55 -47.97 83.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.541 179.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.55 -41.22 94.06 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.605 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -54.91 -37.43 66.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.36 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.06 69.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.359 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 12.6 mmtt -62.29 -28.28 69.61 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.72 31.33 3.21 Favored Glycine 0 N--CA 1.442 -0.918 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.608 179.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.764 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.4 m-85 -101.6 158.81 15.82 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.915 0.388 . . . . 0.0 110.853 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.92 93.94 9.62 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.816 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.635 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 57.6 p -80.4 157.94 26.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.997 0.427 . . . . 0.0 110.813 -178.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.531 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -158.48 140.7 5.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.92 -178.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.8 t -117.37 117.46 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.07 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.869 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -115.14 126.83 55.09 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.996 0.427 . . . . 0.0 110.647 179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.869 ' N ' HD12 ' A' ' 40' ' ' LEU . 4.9 tp -88.0 113.81 24.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.264 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.694 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -100.23 166.9 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 4.1 t0 -53.97 64.91 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.909 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 135.19 -23.13 3.51 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 120.129 -1.034 . . . . 0.0 115.254 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.909 HD23 ' O ' ' A' ' 44' ' ' GLY . 18.2 mt -143.28 163.44 32.96 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 118.366 1.083 . . . . 0.0 112.852 -178.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.818 ' OH ' HD22 ' A' ' 41' ' ' LEU . 30.5 m-85 -110.36 132.28 54.32 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.331 177.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.741 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.04 147.66 29.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.172 0.51 . . . . 0.0 111.955 -179.159 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.737 ' CB ' HD23 ' A' ' 26' ' ' LEU . 94.9 t -120.29 104.19 15.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.56 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.531 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.3 tt0 -109.6 141.26 42.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.359 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.3 123.7 39.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.602 0.715 . . . . 0.0 111.597 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 80.48 108.97 0.29 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.925 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -130.71 112.87 13.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.728 0.299 . . . . 0.0 110.377 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -130.16 170.38 14.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 111.432 -179.285 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 t -79.64 -18.27 51.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.027 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -115.33 137.87 51.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.92 0.39 . . . . 0.0 111.109 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -61.49 -38.9 88.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.634 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -45.83 -31.77 2.25 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.962 0.411 . . . . 0.0 111.016 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 62.7 m-80 -73.14 -49.06 30.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.694 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.12 -43.3 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.991 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -60.91 -49.35 77.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.811 0.338 . . . . 0.0 110.938 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.1 m -61.17 -33.86 74.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.047 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -71.52 -52.49 18.02 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-O 121.739 0.78 . . . . 0.0 109.934 179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.763 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.98 -57.86 9.96 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.787 -178.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.17 -37.72 55.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.41 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.1 ttt85 -65.21 -37.94 88.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.821 178.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.52 -42.83 91.57 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.611 178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.3 mmmm -61.34 -46.56 89.74 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.854 178.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.5 t30 -70.24 -25.41 63.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.738 178.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.442 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.77 -22.96 53.0 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.265 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.56 23.43 5.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.483 -179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.584 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -130.87 148.12 52.6 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 32.4 t70 -91.89 75.04 5.65 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.565 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.674 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.63 141.69 29.61 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.846 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.584 HD12 HG23 ' A' ' 76' ' ' ILE . 1.2 pp -133.27 153.04 36.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.911 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.694 HG22 ' HB1' ' A' ' 59' ' ' ALA . 76.9 t -104.86 137.18 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.031 0.443 . . . . 0.0 111.14 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.584 HG23 HD12 ' A' ' 74' ' ' ILE . 6.7 pt -136.96 136.4 47.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.208 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.439 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.1 tp -102.62 106.2 16.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.434 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -103.22 135.49 44.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.051 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.887 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.857 0.361 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.83 -166.63 1.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.78 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.89 -77.11 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.892 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.5 p -87.87 161.37 17.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.829 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -82.75 111.5 18.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.958 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.1 m 63.38 141.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.978 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 m -102.02 41.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.792 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.537 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -152.35 153.56 24.97 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.483 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.7 mt -144.04 140.5 29.56 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.742 0.306 . . . . 0.0 110.332 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.493 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.8 m-85 -102.32 106.48 17.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.114 0.483 . . . . 0.0 109.968 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 42.6 mttt -124.51 154.78 40.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.467 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.008 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.68 145.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.309 179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tm0? -137.78 134.01 34.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 111.415 -178.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.564 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.2 -5.41 10.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.77 169.47 27.31 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 119.256 -1.45 . . . . 0.0 114.623 179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.74 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.93 140.75 21.85 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.508 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.7 m-85 -151.38 150.08 30.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -60.81 -13.81 17.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.478 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.05 128.9 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-O 120.897 0.38 . . . . 0.0 111.794 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -71.8 -40.97 68.83 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.682 179.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.92 -29.51 20.46 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.232 0.539 . . . . 0.0 109.725 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -81.82 -31.88 31.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.726 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.76 -23.08 58.48 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.03 179.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -83.02 -40.36 20.04 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.624 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -37.29 86.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.211 0.529 . . . . 0.0 109.775 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.919 HD12 ' OD1' ' A' ' 29' ' ' ASN . 31.2 tp -68.21 -47.53 67.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.279 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -58.58 -25.85 63.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.046 0.45 . . . . 0.0 110.503 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -74.75 -41.08 60.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.045 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.919 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.05 -48.71 80.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.813 0.34 . . . . 0.0 110.627 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.88 -38.18 89.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.382 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -54.63 -36.88 64.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.398 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.99 -50.17 64.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.434 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.32 -28.0 69.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.27 32.25 3.53 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.188 -0.914 . . . . 0.0 112.383 179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.796 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -99.18 154.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.973 0.416 . . . . 0.0 110.724 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -81.54 92.51 6.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.004 179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.596 ' HA ' HG22 ' A' ' 50' ' ' ILE . 93.5 p -79.69 155.25 28.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.123 0.487 . . . . 0.0 110.927 -178.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.635 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.39 140.92 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.822 -178.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 42.3 t -118.59 118.17 57.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.118 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -115.65 126.76 54.57 Favored 'General case' 0 CA--C 1.522 -0.103 0 CA-C-O 121.065 0.46 . . . . 0.0 110.561 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.816 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.5 tp -87.8 113.02 23.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.064 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.686 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -96.6 166.91 11.44 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 177.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.471 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -55.92 67.15 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.896 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 136.11 -25.37 3.19 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 120.165 -1.017 . . . . 0.0 114.942 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.896 HD23 ' O ' ' A' ' 44' ' ' GLY . 16.7 mt -143.18 167.09 22.94 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 118.081 0.94 . . . . 0.0 112.953 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.621 ' OH ' HD22 ' A' ' 41' ' ' LEU . 30.6 m-85 -112.83 134.69 54.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.623 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.74 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -109.22 151.18 26.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.161 0.505 . . . . 0.0 111.784 -179.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.727 ' HB ' HD23 ' A' ' 26' ' ' LEU . 86.5 t -123.9 102.19 10.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.565 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.635 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -106.7 141.98 37.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.89 -179.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 123.1 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.61 0.719 . . . . 0.0 111.246 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.45 104.63 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.849 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.535 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -125.73 124.02 40.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.646 0.26 . . . . 0.0 110.666 179.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.04 174.36 10.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.036 0.446 . . . . 0.0 111.404 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m -83.49 -16.7 44.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.211 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.74 130.59 56.41 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.977 0.418 . . . . 0.0 111.172 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.493 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.69 -34.66 67.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.164 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -52.34 -32.57 38.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.418 . . . . 0.0 111.07 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.683 ' O ' HG22 ' A' ' 61' ' ' THR . 2.6 m120 -70.26 -48.45 56.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.693 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.614 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.24 -39.98 92.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.841 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -60.16 -51.78 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.77 0.319 . . . . 0.0 111.265 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.683 HG22 ' O ' ' A' ' 58' ' ' ASN . 15.4 t -58.91 -34.75 72.04 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.94 0.4 . . . . 0.0 110.855 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.008 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.4 -50.96 33.15 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.741 0.781 . . . . 0.0 110.049 179.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.0 -58.19 7.8 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.044 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.6 -35.46 65.84 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.65 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -63.96 -40.9 97.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 179.083 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.35 -40.07 95.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.451 178.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 2.0 mmmm -61.71 -47.24 86.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.719 178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -26.34 65.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.809 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.51 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -76.67 -21.93 54.71 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.587 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.66 23.21 5.74 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.385 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.609 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.58 148.97 52.44 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 8.3 t0 -92.08 74.72 5.51 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.807 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.743 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.8 143.16 27.62 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.134 0.492 . . . . 0.0 111.911 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.7 pp -136.46 162.95 34.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.7 178.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.614 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.7 t -111.58 136.77 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.959 0.409 . . . . 0.0 111.013 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 9.8 tt -140.78 140.01 33.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.12 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.537 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.2 tp -89.54 117.88 28.76 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.139 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -88.44 101.04 13.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 61.4 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.884 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.848 0.356 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -107.72 97.28 7.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.25 -39.8 5.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.895 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -149.38 175.59 11.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 t -176.51 -42.74 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.9 m 59.62 83.2 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.81 22.48 3.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.13 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.75 -158.83 17.42 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.574 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 2.7 mp -144.22 142.47 30.52 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.503 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -100.9 107.28 18.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 121.146 0.498 . . . . 0.0 110.018 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -127.2 155.74 42.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.596 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.1 137.58 38.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.319 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.2 179.829 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -130.36 133.3 46.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.336 . . . . 0.0 111.024 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.546 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -104.8 -4.79 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -179.047 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.67 174.73 28.76 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 119.05 -1.548 . . . . 0.0 114.674 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.759 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.34 140.37 21.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.548 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.8 m-85 -144.75 148.84 34.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.834 0.35 . . . . 0.0 111.401 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 25.7 tttt -61.06 -14.42 23.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.448 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.2 t -107.17 128.94 61.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.092 0.472 . . . . 0.0 111.92 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.4 OUTLIER -68.72 -42.74 77.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.579 179.655 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.87 -32.04 60.33 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 109.852 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -77.45 -35.16 54.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.315 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.554 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.31 -18.97 61.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.771 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.81 -37.62 20.55 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.488 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.4 t -65.03 -37.0 86.16 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 178.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.98 HD12 ' OD1' ' A' ' 29' ' ' ASN . 33.7 tp -68.49 -50.41 52.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.198 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.507 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.45 -26.07 52.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -40.49 60.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.146 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.98 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.65 -48.71 80.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.919 0.39 . . . . 0.0 110.665 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.966 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.72 -39.06 90.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.359 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -54.67 -37.13 65.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.336 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.11 -49.59 68.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.425 179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.0 mmtt -62.28 -28.3 69.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.29 32.88 3.09 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.473 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -101.82 159.08 15.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.983 0.421 . . . . 0.0 110.682 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -87.04 94.69 9.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.879 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.585 ' HA ' HG22 ' A' ' 50' ' ' ILE . 87.4 p -80.38 157.04 26.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.09 0.472 . . . . 0.0 110.818 -178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.91 141.69 6.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.771 -178.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.615 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 20.6 t -119.69 117.93 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.494 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.742 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -109.33 122.6 47.72 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-O 120.874 0.369 . . . . 0.0 110.77 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -84.13 111.62 19.5 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.159 0.504 . . . . 0.0 111.091 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.633 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -100.11 167.26 10.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.368 178.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.582 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -55.91 64.62 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.827 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 124.12 -10.16 8.33 Favored Glycine 0 CA--C 1.522 0.525 0 C-N-CA 120.499 -0.857 . . . . 0.0 114.467 178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.827 HD23 ' O ' ' A' ' 44' ' ' GLY . 27.8 mt -144.15 150.79 38.61 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 117.94 0.87 . . . . 0.0 112.813 -179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.694 ' OH ' HD22 ' A' ' 41' ' ' LEU . 24.1 m-85 -109.6 131.65 54.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.563 178.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.759 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -105.08 147.79 27.51 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.17 0.509 . . . . 0.0 112.022 -179.473 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.826 ' HB ' HD23 ' A' ' 26' ' ' LEU . 93.7 t -120.67 101.64 11.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.362 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.562 ' HB3' HG23 ' A' ' 38' ' ' ILE . 11.3 tt0 -109.02 142.25 39.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.595 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.966 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -135.14 123.38 39.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.539 0.685 . . . . 0.0 111.5 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 81.24 105.64 0.34 Allowed Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 114.827 -1.078 . . . . 0.0 113.054 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.57 116.36 19.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.778 0.323 . . . . 0.0 110.232 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -136.58 173.53 11.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.027 0.441 . . . . 0.0 111.604 -179.158 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.42 -17.85 40.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.013 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.07 131.92 56.21 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.888 0.375 . . . . 0.0 111.078 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.1 ttpt -58.66 -38.96 79.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.397 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -44.98 -33.89 2.21 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.963 0.411 . . . . 0.0 110.782 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.456 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 26.8 m-80 -72.47 -48.78 38.03 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.331 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.574 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.69 -45.23 85.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.001 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.33 -50.65 73.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.864 0.364 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 5.2 m -58.58 -36.18 73.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.799 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.61 34.24 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-O 121.709 0.766 . . . . 0.0 110.065 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.769 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.93 -59.54 4.59 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.026 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.96 -37.89 47.27 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.567 179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.4 ttt180 -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.983 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.96 -42.93 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.776 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.0 OUTLIER -61.46 -47.13 87.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.658 178.83 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -25.86 64.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.74 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.476 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.61 -22.94 53.49 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.315 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.33 23.18 5.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.515 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.572 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -131.21 148.94 52.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.462 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 30.0 t70 -92.93 74.44 4.82 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.07 142.06 28.98 Favored 'General case' 0 CA--C 1.524 -0.029 0 CA-C-O 121.108 0.48 . . . . 0.0 111.751 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.437 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -133.4 149.91 31.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.03 179.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.574 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.6 t -102.72 136.27 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.895 0.379 . . . . 0.0 111.078 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 pt -140.49 142.78 30.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.25 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.459 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 19.5 tp -95.48 107.54 19.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.279 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -98.18 124.96 43.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.218 -179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.916 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 33.9 mt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.2 120.96 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.935 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -126.06 -44.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.987 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -64.52 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.952 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -150.66 142.1 23.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.9 p -107.84 -39.57 5.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.8 t 63.64 126.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.9 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.774 ' O ' HD22 ' A' ' 9' ' ' LEU . . . -79.14 -172.46 42.49 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.52 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 8' ' ' GLY . 3.1 mm? -143.31 141.02 30.84 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 45.7 m-85 -101.62 106.35 17.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.058 0.456 . . . . 0.0 109.98 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 10.2 mttt -125.68 153.18 44.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.689 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.88 136.65 39.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.164 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -129.69 134.78 47.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.808 0.337 . . . . 0.0 111.163 -179.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.521 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.07 -6.16 10.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -178.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.44 173.06 29.61 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 118.792 -1.671 . . . . 0.0 114.944 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.17 137.52 18.52 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.467 178.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.9 m-85 -146.2 149.35 33.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.784 0.326 . . . . 0.0 111.058 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 21.5 tttt -59.69 -14.66 15.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.828 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.51 130.29 60.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.096 0.474 . . . . 0.0 112.049 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -72.23 -40.6 67.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.623 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.62 -34.18 57.62 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-O 121.303 0.573 . . . . 0.0 109.791 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -75.32 -32.67 61.02 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.212 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.39 -20.2 60.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.034 179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -83.34 -38.48 22.0 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.681 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.86 -38.23 85.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.315 0.579 . . . . 0.0 109.646 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 48.6 tp -65.31 -51.1 62.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.149 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.539 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -58.98 -24.85 63.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.574 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.377 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.3 -46.93 87.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.426 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.36 -42.65 87.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.622 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -55.34 -37.28 67.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.311 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -52.54 -51.54 59.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.296 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 3.5 mmpt? -63.2 -28.97 70.4 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.21 33.28 2.79 Favored Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.528 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.95 160.14 14.75 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.925 0.393 . . . . 0.0 110.81 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -88.96 94.68 10.03 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.773 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -80.6 157.55 25.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.146 0.498 . . . . 0.0 110.861 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -157.7 140.16 5.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.724 -178.699 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 23' ' ' ALA . 21.4 t -115.11 112.51 40.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.282 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -104.73 121.65 44.04 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.998 0.428 . . . . 0.0 110.714 179.595 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.816 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.8 tp -84.46 110.3 18.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.312 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.65 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -94.0 166.32 12.21 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.46 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.584 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 24.1 t0 -57.24 64.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -178.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.882 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 126.45 -9.24 7.35 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.468 -0.872 . . . . 0.0 114.371 178.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.882 HD23 ' O ' ' A' ' 44' ' ' GLY . 42.7 mt -143.89 152.59 41.34 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 117.586 0.693 . . . . 0.0 112.4 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.652 ' OH ' HD22 ' A' ' 41' ' ' LEU . 23.8 m-85 -110.85 134.82 52.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.444 177.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.532 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -117.27 155.51 29.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.967 0.413 . . . . 0.0 111.455 -179.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.705 ' HB ' HD23 ' A' ' 26' ' ' LEU . 59.3 t -125.21 109.91 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.959 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.48 ' HB3' HG23 ' A' ' 38' ' ' ILE . 32.9 tt0 -110.09 142.05 42.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.034 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.82 122.76 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 121.601 0.715 . . . . 0.0 111.525 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.0 105.0 0.32 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.826 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -128.41 113.31 15.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.696 0.284 . . . . 0.0 110.429 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -132.15 173.4 11.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.23 0.538 . . . . 0.0 111.389 -179.274 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -16.27 46.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.106 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.93 129.44 56.47 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.892 0.377 . . . . 0.0 111.094 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.509 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.4 OUTLIER -56.1 -35.36 66.96 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.25 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.9 -32.2 31.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.028 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.451 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 11.3 m120 -70.34 -49.83 45.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.558 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.3 -41.25 88.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.011 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -60.22 -50.86 72.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.7 0.285 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.8 m -59.0 -36.9 75.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.83 -51.43 40.71 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-O 121.834 0.826 . . . . 0.0 110.17 179.375 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.754 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.61 -60.3 3.53 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.211 -1.358 . . . . 0.0 111.124 -177.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -36.97 40.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.462 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -65.41 -39.3 91.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.835 178.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.7 -41.92 95.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.662 179.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 3.4 mttt -61.59 -46.65 88.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.698 178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -69.74 -25.52 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.691 178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.96 -22.72 52.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.402 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 24.14 5.42 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.545 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.52 148.29 52.3 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 24.1 t0 -92.02 72.48 5.55 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.852 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.702 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.81 141.39 30.52 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.1 0.476 . . . . 0.0 111.722 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 6.9 pt -133.61 152.22 34.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.007 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.602 HG22 ' HB1' ' A' ' 59' ' ' ALA . 95.9 t -103.39 136.2 37.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.867 0.365 . . . . 0.0 111.039 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.1 tt -138.76 140.8 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.34 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.519 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.1 tp -99.38 104.01 15.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.128 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -93.16 115.15 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.023 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.852 179.794 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.835 0.35 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -150.69 114.56 5.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.39 155.18 37.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.9 p -70.19 -174.96 0.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.845 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.7 79.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.94 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.9 m -118.83 95.97 5.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.883 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.1 p -116.3 -37.93 3.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.872 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.542 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -98.51 170.86 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.447 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 15.2 mt -143.99 140.95 29.9 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -101.83 106.72 17.73 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -124.8 155.65 39.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.47 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.992 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.59 141.61 23.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.435 179.627 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.441 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 17.7 tt0 -134.47 134.43 41.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.729 0.3 . . . . 0.0 111.319 -179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.651 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.71 -5.11 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.14 172.08 27.99 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 119.071 -1.538 . . . . 0.0 114.82 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.814 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.29 145.51 25.39 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 178.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.493 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.1 m-85 -151.63 151.62 31.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.004 0.431 . . . . 0.0 111.33 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 1.1 tttt -60.45 -15.46 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.422 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 24.7 t -106.38 128.39 60.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.001 0.429 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.24 -40.46 74.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 179.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.3 -33.08 62.96 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.267 0.556 . . . . 0.0 109.739 179.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -75.97 -33.83 59.77 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.264 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.91 -22.75 61.44 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.775 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.71 -37.21 31.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.596 179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -38.58 89.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.215 0.531 . . . . 0.0 109.758 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.929 HD12 ' OD1' ' A' ' 29' ' ' ASN . 15.2 tp -66.93 -47.28 72.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.23 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.782 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -60.27 -25.61 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 110.578 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -40.52 57.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.018 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.929 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -60.25 -48.4 81.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.811 0.339 . . . . 0.0 110.626 -179.924 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.951 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.5 -38.76 91.17 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.255 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -54.96 -36.58 65.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.278 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.17 -48.62 73.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.229 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.3 -28.17 69.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 31.14 3.55 Favored Glycine 0 N--CA 1.442 -0.936 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.497 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.0 m-85 -100.37 156.92 16.98 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.794 0.331 . . . . 0.0 110.711 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.83 95.41 9.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.999 179.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.782 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 19.1 p -80.24 155.85 27.14 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.201 0.524 . . . . 0.0 111.044 -178.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.657 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -155.47 139.88 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.548 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 40.8 t -117.87 116.3 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.543 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.904 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -117.98 128.7 55.04 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.864 0.364 . . . . 0.0 110.458 179.734 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.904 ' N ' HD12 ' A' ' 40' ' ' LEU . 6.8 tp -91.36 117.06 29.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.954 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.697 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -107.7 143.85 35.62 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.38 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.458 ' HB2' ' CE ' ' A' ' 42' ' ' LYS . 1.4 m-20 38.73 -85.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.806 0.336 . . . . 0.0 110.692 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.638 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -141.25 14.7 2.77 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.06 178.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.697 ' HG ' ' CE ' ' A' ' 42' ' ' LYS . 17.3 mt -118.47 158.28 25.63 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.016 0.436 . . . . 0.0 111.116 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.789 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 22.7 m-85 -116.13 135.5 53.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.178 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.814 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.32 149.4 28.7 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.107 0.48 . . . . 0.0 111.268 -179.748 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.641 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.7 t -122.04 100.45 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.609 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.68 ' NE2' ' HB2' ' A' ' 52' ' ' ALA . 4.5 tt0 -104.75 142.01 35.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.78 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.951 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.03 122.76 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.438 0.637 . . . . 0.0 111.425 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.475 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 82.01 107.38 0.4 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.78 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.68 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -127.7 121.06 29.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.643 0.258 . . . . 0.0 110.584 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -141.19 172.31 12.86 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.111 0.481 . . . . 0.0 111.424 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 m -83.99 -16.22 44.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.221 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 6.1 m -111.63 127.49 55.77 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.84 0.352 . . . . 0.0 111.198 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.507 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -54.82 -36.49 65.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.189 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -52.97 -30.03 32.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.423 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 1.4 m-20 -71.81 -49.61 37.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.639 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.471 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -61.41 -40.87 95.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.937 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.24 -50.7 72.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 m -58.38 -36.57 73.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.674 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.992 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -69.24 -50.04 50.78 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.746 0.784 . . . . 0.0 110.065 179.355 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.7 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.76 -59.22 4.9 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.284 -1.325 . . . . 0.0 111.135 -177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.49 -36.1 63.8 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.792 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.9 -40.82 97.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.961 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -63.81 -39.22 93.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.495 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.8 mttm -62.66 -46.66 87.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.569 178.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.2 -26.23 64.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.734 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.483 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.59 -22.26 54.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.508 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.7 23.15 5.75 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.592 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.33 148.56 52.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 10.0 t70 -91.93 74.63 5.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.752 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.725 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.86 142.0 29.2 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.151 0.5 . . . . 0.0 112.117 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.6 pt -134.07 160.98 41.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.748 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.482 HG22 HG13 ' A' ' 12' ' ' VAL . 98.5 t -113.1 137.58 45.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.904 0.383 . . . . 0.0 111.072 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 31.2 pt -139.55 140.11 37.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.454 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.542 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.8 tp -92.41 105.75 17.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -96.77 121.74 38.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.046 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.928 179.91 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -79.27 128.25 33.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.41 -171.21 1.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -70.22 -55.24 9.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.993 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 t 62.87 121.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.863 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.2 m -146.89 121.96 10.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.543 ' O ' HD11 ' A' ' 77' ' ' LEU . 0.3 OUTLIER -152.78 154.38 35.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.921 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.774 ' O ' HD22 ' A' ' 9' ' ' LEU . . . 111.88 -157.91 14.66 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.353 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 8' ' ' GLY . 3.0 mm? -143.24 138.6 29.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.64 ' CE1' HD13 ' A' ' 77' ' ' LEU . 41.9 m-85 -102.35 106.08 16.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.119 0.485 . . . . 0.0 110.172 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.422 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 12.4 mttm -125.14 153.46 42.98 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.474 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.035 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.97 139.99 26.64 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.329 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.342 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -134.33 134.35 41.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.617 0.246 . . . . 0.0 111.236 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.568 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -106.4 -4.8 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.128 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 157.58 175.87 29.0 Favored Glycine 0 C--N 1.337 0.603 0 C-N-CA 118.993 -1.575 . . . . 0.0 114.757 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.813 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.78 148.47 27.9 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.588 ' HE1' HD22 ' A' ' 26' ' ' LEU . 4.4 m-85 -152.76 151.88 31.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.959 0.409 . . . . 0.0 111.441 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -60.65 -14.82 22.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.421 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.46 127.76 64.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.143 0.497 . . . . 0.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -70.86 -38.21 73.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.344 179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -33.57 67.94 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.172 0.511 . . . . 0.0 109.658 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -75.62 -33.5 60.51 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.115 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.74 -18.54 60.97 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.798 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.55 -36.96 21.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.478 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -38.05 84.19 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.81 HD12 ' ND2' ' A' ' 29' ' ' ASN . 49.0 tp -66.22 -51.6 56.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.105 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.67 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.23 -24.37 59.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.306 178.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -41.04 67.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.587 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.81 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.53 -46.95 87.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.45 179.66 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.45 -41.18 93.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.45 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -55.05 -36.86 66.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.298 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.55 -51.44 62.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.303 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 4.0 mmpt? -62.6 -28.61 70.01 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.55 32.83 2.83 Favored Glycine 0 N--CA 1.443 -0.854 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.585 179.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.9 m-85 -101.2 158.51 15.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.698 179.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -87.38 94.93 9.83 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.923 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.67 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 21.7 p -80.56 157.01 26.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.15 0.5 . . . . 0.0 110.972 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.552 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.59 141.08 6.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.643 -178.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.88 116.56 52.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.51 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.912 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -116.94 129.38 56.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 179.68 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.912 ' N ' HD12 ' A' ' 40' ' ' LEU . 9.7 tp -91.35 117.64 29.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.191 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.681 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -111.11 151.93 27.54 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.42 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.553 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 32.12 -85.72 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.74 0.305 . . . . 0.0 110.731 -178.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.681 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -139.76 10.34 3.14 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 121.442 -0.408 . . . . 0.0 112.334 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.674 ' O ' HD12 ' A' ' 41' ' ' LEU . 10.3 mt -117.42 161.66 19.2 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.061 0.43 . . . . 0.0 111.612 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.865 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 25.6 m-85 -116.22 137.33 52.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.173 178.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.83 146.81 31.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.065 0.459 . . . . 0.0 111.248 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.716 ' HB ' HD23 ' A' ' 26' ' ' LEU . 72.8 t -117.74 100.33 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.58 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.552 ' HB3' HG23 ' A' ' 38' ' ' ILE . 37.6 tt0 -104.89 140.37 38.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.136 -179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.34 123.07 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.562 0.696 . . . . 0.0 111.57 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.479 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.71 106.99 0.25 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 114.739 -1.119 . . . . 0.0 112.879 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.422 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -130.13 115.58 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.742 0.306 . . . . 0.0 110.484 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -134.27 173.5 11.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.227 0.537 . . . . 0.0 111.495 -179.252 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.52 -16.35 45.84 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.157 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.02 129.2 56.28 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.829 0.347 . . . . 0.0 111.081 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.519 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.9 OUTLIER -56.25 -35.15 67.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.221 -179.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -52.44 -30.8 31.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.956 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.449 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 27.9 m120 -71.86 -49.92 33.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.71 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.513 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.86 -41.24 91.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.055 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.28 -51.01 71.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.998 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.69 -34.81 73.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.94 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.035 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.32 -51.6 28.96 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.804 0.811 . . . . 0.0 109.892 179.425 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.762 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.49 -58.91 5.63 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.932 -178.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.32 -37.28 55.44 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.476 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 61' ' ' THR . 0.7 OUTLIER -64.69 -38.93 92.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.823 178.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.67 -41.13 96.3 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.553 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 48.0 mttm -61.85 -46.8 87.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.654 178.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -69.66 -25.68 64.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.818 178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.483 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.79 -22.41 53.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.278 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.34 24.18 5.47 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.421 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.74 147.98 52.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 23.0 t70 -91.58 73.42 5.93 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.607 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -83.99 140.92 31.58 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.16 0.505 . . . . 0.0 111.859 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.646 HD12 HG23 ' A' ' 76' ' ' ILE . 1.1 pp -132.07 150.34 33.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.88 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.513 HG22 ' HB1' ' A' ' 59' ' ' ALA . 89.6 t -104.12 134.83 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.848 0.356 . . . . 0.0 110.966 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.72 HD12 ' HG3' ' A' ' 78' ' ' GLU . 1.3 pt -134.28 136.9 52.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.127 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.64 HD13 ' CE1' ' A' ' 10' ' ' TYR . 17.8 tp -97.61 105.8 18.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.202 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.72 ' HG3' HD12 ' A' ' 76' ' ' ILE . 85.8 mt-10 -95.28 120.35 35.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.011 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.251 1.178 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.843 179.86 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.664 ' N ' HD13 ' A' ' 1' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.792 0.33 . . . . 0.0 111.374 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -170.34 106.41 0.31 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.904 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -133.52 -45.89 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.993 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.5 t -135.55 -46.53 0.68 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.918 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 t -59.7 121.46 11.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.867 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -156.1 151.73 27.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.5 121.73 45.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.571 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 133.04 165.0 11.04 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.582 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.3 mt -143.92 140.44 29.71 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.517 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.2 m-85 -101.76 106.53 17.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.177 0.513 . . . . 0.0 110.127 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -126.15 153.24 44.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.344 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.018 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.21 138.44 31.63 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.145 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.439 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 16.1 tt0 -132.12 133.38 44.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.717 0.294 . . . . 0.0 111.127 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.635 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.1 OUTLIER -107.34 -4.97 10.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.275 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.56 171.04 28.24 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 119.152 -1.499 . . . . 0.0 115.034 178.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.873 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.03 144.46 24.89 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 178.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.454 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.4 m-85 -152.84 151.05 29.98 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.534 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -59.46 -15.33 16.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.598 179.593 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.63 128.35 61.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.95 0.405 . . . . 0.0 111.8 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.47 -39.1 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.45 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -32.69 63.56 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -76.34 -32.89 58.92 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.183 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.648 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.99 -23.6 61.44 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.722 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -37.46 30.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.717 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -65.48 -38.9 91.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.237 0.541 . . . . 0.0 109.877 179.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.932 HD12 ' OD1' ' A' ' 29' ' ' ASN . 14.7 tp -66.99 -45.91 76.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.232 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 37' ' ' SER . . . -61.13 -26.25 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.058 0.456 . . . . 0.0 110.537 179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.69 -40.87 61.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.041 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.932 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.6 -48.43 81.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.758 0.313 . . . . 0.0 110.642 179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.957 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.25 -38.26 88.57 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.282 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -54.9 -37.02 65.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.232 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.72 67.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.423 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.35 -28.28 69.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 107.42 33.37 3.16 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.21 -0.905 . . . . 0.0 112.438 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.787 ' CG ' HD11 ' A' ' 62' ' ' LEU . 7.3 m-85 -100.75 156.28 17.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.94 0.4 . . . . 0.0 110.779 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.02 94.51 8.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.84 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.557 ' HA ' HG22 ' A' ' 50' ' ' ILE . 91.9 p -80.23 155.51 27.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.206 0.527 . . . . 0.0 111.126 -178.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.645 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.62 137.7 7.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.717 -178.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.648 HG13 ' HB1' ' A' ' 23' ' ' ALA . 22.0 t -117.6 115.69 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.38 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.753 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -119.83 134.86 55.09 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.849 HD22 ' CZ ' ' A' ' 46' ' ' TYR . 15.2 tp -94.77 118.07 31.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.95 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.699 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -110.03 152.9 25.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.366 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.544 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.5 OUTLIER 30.38 -86.91 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.215 0.322 . . . . 0.0 110.815 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.699 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -137.38 9.96 3.78 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 121.182 -0.532 . . . . 0.0 112.253 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.76 ' O ' HD12 ' A' ' 41' ' ' LEU . 10.6 mt -117.34 160.52 20.99 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.042 0.449 . . . . 0.0 111.584 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.849 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 21.5 m-85 -115.3 136.55 52.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.076 178.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.873 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.82 149.62 28.01 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.186 0.517 . . . . 0.0 111.412 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.573 ' HB ' HD23 ' A' ' 26' ' ' LEU . 42.6 t -122.54 99.37 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.445 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.645 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -104.66 142.22 35.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.984 -179.282 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.957 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.55 122.59 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-O 121.509 0.671 . . . . 0.0 111.396 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.559 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.96 104.81 0.26 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 114.818 -1.083 . . . . 0.0 112.867 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.644 ' HB2' ' OE1' ' A' ' 49' ' ' GLN . . . -127.24 125.4 40.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -144.25 173.67 11.56 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.135 0.493 . . . . 0.0 111.574 -179.337 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 97.1 p -83.47 -16.59 45.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.062 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.42 129.74 56.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.886 0.374 . . . . 0.0 111.078 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 1.1 tmtp? -56.9 -34.85 68.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.237 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -51.52 -31.9 25.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.883 0.373 . . . . 0.0 111.134 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.464 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 73.3 m-80 -71.68 -49.57 38.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.697 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.502 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -60.45 -43.32 96.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.071 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.44 -51.44 69.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.77 0.319 . . . . 0.0 110.931 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 70.6 m -57.88 -37.15 73.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.878 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.018 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.77 -51.12 44.45 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.714 0.768 . . . . 0.0 110.304 179.555 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.74 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.02 -59.67 4.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.099 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.73 -36.6 57.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.507 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.26 -39.6 94.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.765 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.64 -40.46 95.49 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.533 178.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 8.7 mttm -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.588 178.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -68.58 -25.94 65.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.846 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.502 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.97 -22.26 53.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.5 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 23.13 5.88 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.418 -179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.564 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.34 148.96 52.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.379 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.475 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 29.6 t70 -92.63 74.67 5.06 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.954 -0.299 . . . . 0.0 110.958 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.37 140.67 30.58 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.105 0.478 . . . . 0.0 111.907 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 11.3 pt -132.89 150.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.969 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.502 HG22 ' HB1' ' A' ' 59' ' ' ALA . 99.3 t -103.91 136.83 35.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.899 0.38 . . . . 0.0 111.077 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.536 HD12 ' CD ' ' A' ' 78' ' ' GLU . 2.7 pt -137.34 139.2 44.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.347 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.571 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.1 tp -103.75 105.1 15.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.362 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.536 ' CD ' HD12 ' A' ' 76' ' ' ILE . 48.5 mt-10 -125.46 147.79 49.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.13 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.203 -0.904 . . . . 0.0 110.816 179.919 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.419 HD23 ' OG1' ' A' ' 4' ' ' THR . 4.2 mp . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.915 0.388 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.41 -47.42 0.26 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -105.53 92.09 4.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.89 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.419 ' OG1' HD23 ' A' ' 1' ' ' LEU . 22.5 m -130.19 -46.12 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.6 m -170.54 128.12 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.01 34.68 2.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.907 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.82 -30.65 11.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.757 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -176.02 162.1 30.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.506 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 0.5 OUTLIER -143.9 139.29 29.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 179.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.4 m-85 -101.5 106.62 17.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.088 0.47 . . . . 0.0 109.896 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -125.54 152.46 45.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.451 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.037 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.59 136.65 38.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.295 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.283 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -128.06 135.48 49.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.598 0.237 . . . . 0.0 111.111 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.668 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.32 -6.14 10.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.61 173.08 29.82 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 118.795 -1.669 . . . . 0.0 115.374 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.34 142.68 23.38 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 114.62 -0.79 . . . . 0.0 108.949 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.33 150.38 28.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.949 0.405 . . . . 0.0 111.331 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 10.9 pttp -59.89 -15.38 21.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.617 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -107.88 127.27 64.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 121.005 0.431 . . . . 0.0 111.826 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.1 OUTLIER -72.33 -38.26 68.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.658 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.29 -34.92 61.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.249 0.547 . . . . 0.0 109.591 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -73.98 -32.37 63.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.124 178.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.443 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.78 -19.99 60.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.978 179.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -82.12 -38.72 24.35 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.733 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.53 -36.75 79.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.245 0.545 . . . . 0.0 109.799 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.84 HD12 ' ND2' ' A' ' 29' ' ' ASN . 51.0 tp -65.52 -51.95 56.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.472 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.11 -28.48 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -41.7 85.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.617 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.84 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -59.8 -47.92 83.78 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.692 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.975 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.76 -42.1 88.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.673 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.9 -37.17 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.395 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -53.23 -51.11 63.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.344 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.521 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 1.2 mmpt? -62.61 -28.76 70.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.3 32.78 2.9 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.488 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.723 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.0 m-85 -102.11 159.82 15.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.959 0.409 . . . . 0.0 110.716 179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -88.33 94.88 9.98 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.907 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.586 ' HA ' HG22 ' A' ' 50' ' ' ILE . 78.2 p -80.69 156.62 26.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.155 0.503 . . . . 0.0 110.91 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.92 135.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.874 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.4 t -112.06 112.04 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.111 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.781 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -114.67 132.21 56.47 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.857 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.781 ' N ' HD12 ' A' ' 40' ' ' LEU . 10.8 tp -90.67 111.88 23.39 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.3 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.707 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.5 OUTLIER -104.67 152.46 22.46 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.429 ' HB3' ' NZ ' ' A' ' 42' ' ' LYS . 2.3 t70 32.99 -83.18 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.844 0.354 . . . . 0.0 111.256 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.646 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -144.91 17.33 1.97 Allowed Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.709 ' O ' HD12 ' A' ' 41' ' ' LEU . 8.8 mt -126.21 166.44 17.08 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.123 0.487 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.649 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 26.2 m-85 -117.4 138.56 51.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.758 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -119.08 156.52 29.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.986 0.422 . . . . 0.0 110.806 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.668 HG12 HD11 ' A' ' 14' ' ' ILE . 58.7 t -124.62 109.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.357 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' HG23 ' A' ' 38' ' ' ILE . 35.3 tt0 -107.41 140.99 39.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.473 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.975 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.71 122.95 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.536 0.684 . . . . 0.0 111.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.442 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.58 104.96 0.29 Allowed Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.871 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -127.95 112.65 14.9 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -130.39 171.05 13.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.078 0.466 . . . . 0.0 111.472 -179.188 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 t -80.83 -17.75 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.032 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -113.16 130.92 56.05 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.81 0.338 . . . . 0.0 111.053 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 16.9 ttpt -57.08 -38.85 73.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.386 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.72 -31.38 2.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.099 0.476 . . . . 0.0 110.776 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 33.4 m120 -72.21 -49.76 32.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.319 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.726 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -56.87 -43.32 81.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.118 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -60.29 -49.61 76.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.861 0.362 . . . . 0.0 110.843 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.434 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.7 m -60.18 -35.43 75.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.037 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.29 -52.87 19.67 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.874 0.845 . . . . 0.0 110.147 179.371 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.761 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.48 -58.92 5.57 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 114.13 -1.395 . . . . 0.0 110.899 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.63 -37.76 51.68 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.4 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.0 ttt-85 -65.29 -37.97 88.8 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.798 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.42 -42.5 92.42 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.783 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 18.6 mttm -61.54 -46.51 89.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.696 178.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -69.78 -25.34 63.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.658 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.478 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.39 -23.17 50.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.283 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.05 23.97 5.33 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.524 -179.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.529 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.04 148.76 52.79 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.459 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 12.8 t70 -92.24 73.48 5.38 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.71 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.1 140.42 30.24 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 121.079 0.466 . . . . 0.0 111.681 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.51 HD12 HG23 ' A' ' 76' ' ' ILE . 1.0 OUTLIER -132.87 152.35 35.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.003 179.211 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.726 HG22 ' HB1' ' A' ' 59' ' ' ALA . 86.7 t -101.65 138.04 27.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.943 0.401 . . . . 0.0 111.051 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.51 HG23 HD12 ' A' ' 74' ' ' ILE . 7.0 pt -141.3 138.14 33.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.252 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.757 HD11 ' HA3' ' A' ' 8' ' ' GLY . 11.7 tp -91.25 107.27 19.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.288 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -100.4 124.86 46.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.053 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.9 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 mt . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.78 0.324 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.39 -31.58 7.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.993 179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -148.2 142.99 26.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 58.0 m 60.33 102.8 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.82 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.09 78.67 7.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.983 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.69 127.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.817 -179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.8 p -149.72 123.8 9.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.403 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 121.29 151.31 8.52 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.409 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.2 mt -143.96 139.67 29.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.9 m-85 -101.39 106.29 17.42 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.016 0.436 . . . . 0.0 110.209 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.33 154.37 43.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.607 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.039 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -106.31 140.03 25.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.277 179.821 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.657 ' HB3' HD11 ' A' ' 74' ' ' ILE . 4.4 tt0 -132.09 136.95 47.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.743 0.306 . . . . 0.0 111.145 -179.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.51 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -109.97 -6.28 11.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -179.037 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 161.78 172.71 29.52 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.892 -1.623 . . . . 0.0 115.021 178.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.505 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -150.97 134.34 16.2 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 114.856 -0.672 . . . . 0.0 109.474 178.406 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.634 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -143.34 149.0 37.15 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.745 0.307 . . . . 0.0 111.226 -179.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -61.38 -12.0 12.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.894 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.55 129.06 63.63 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.951 0.405 . . . . 0.0 112.033 -179.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.4 ttpt -70.31 -41.53 73.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.684 179.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.38 -33.71 54.82 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.217 0.532 . . . . 0.0 109.803 179.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -76.48 -32.29 58.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.321 178.459 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.68 -21.18 60.34 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.98 179.416 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -83.68 -38.03 22.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.2 t -67.07 -37.21 83.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.187 0.518 . . . . 0.0 109.648 179.061 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.827 HD12 ' ND2' ' A' ' 29' ' ' ASN . 44.3 tp -66.98 -51.89 49.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.3 -24.3 59.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -72.44 -41.36 66.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.635 179.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.827 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -59.27 -46.93 87.19 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.532 179.696 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.961 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.54 -40.66 95.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.633 179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -36.91 66.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.38 179.73 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.7 -51.42 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.31 179.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.63 -28.52 69.96 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.692 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.28 32.71 2.92 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.65 179.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.8 m-85 -100.71 156.48 17.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.985 0.421 . . . . 0.0 110.779 179.56 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -85.3 94.54 8.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.655 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 29.5 p -80.03 155.54 27.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.919 -178.664 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.606 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -154.35 135.8 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.741 -178.587 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 23' ' ' ALA . 40.2 t -112.91 111.01 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.127 179.918 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.818 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -105.21 121.6 44.18 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.013 0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.818 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.7 tp -84.6 110.51 18.77 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.979 179.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.632 ' HG3' ' H ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -93.85 166.4 12.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.248 178.464 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.569 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 11.0 t0 -57.04 66.51 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.798 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 124.38 -9.85 8.23 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 120.486 -0.864 . . . . 0.0 114.45 178.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.798 HD23 ' O ' ' A' ' 44' ' ' GLY . 44.6 mt -144.66 154.12 42.46 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 117.707 0.753 . . . . 0.0 112.581 -179.395 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.642 ' OH ' HD22 ' A' ' 41' ' ' LEU . 24.0 m-85 -111.08 134.89 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.444 178.065 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -117.14 155.39 29.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.062 0.458 . . . . 0.0 111.409 -179.547 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.75 ' HB ' HD23 ' A' ' 26' ' ' LEU . 60.2 t -126.46 108.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.358 -179.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.606 ' HB3' HG23 ' A' ' 38' ' ' ILE . 4.7 tt0 -109.77 143.26 39.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.696 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.961 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.42 123.54 38.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.521 0.677 . . . . 0.0 111.746 179.799 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.472 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.77 104.18 0.26 Allowed Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.968 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.6 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -126.73 120.58 29.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.676 0.274 . . . . 0.0 110.32 179.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -139.17 171.36 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.033 0.444 . . . . 0.0 111.581 -179.114 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -80.97 -17.34 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.962 179.53 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.01 131.58 56.3 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.025 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 8.2 ttpt -57.8 -37.63 74.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.309 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -46.18 -32.77 3.18 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.041 0.448 . . . . 0.0 110.988 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.454 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 45.9 m-80 -71.83 -49.61 36.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.736 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.6 -44.18 85.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.206 179.581 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -58.79 -51.92 67.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.757 0.313 . . . . 0.0 111.192 -179.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -59.59 -34.11 72.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.059 -179.871 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.039 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.92 -53.2 15.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.83 0.824 . . . . 0.0 110.138 179.561 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.752 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.75 -58.56 6.79 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.911 -178.041 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.37 -37.67 56.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.396 179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 61' ' ' THR . 2.0 ttt180 -64.64 -37.65 88.29 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.788 178.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.62 -42.29 91.71 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.721 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 20.7 mttt -61.53 -46.61 89.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.682 178.71 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -69.88 -25.32 63.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.459 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -77.6 -23.25 49.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.217 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.38 24.25 5.13 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.53 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.87 148.84 52.57 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.302 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 22.5 t0 -92.63 74.28 5.06 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.727 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.728 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.61 142.1 28.1 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 121.183 0.516 . . . . 0.0 111.705 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.768 ' O ' HD12 ' A' ' 74' ' ' ILE . 2.2 pp -134.72 153.57 35.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.801 178.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.736 HG22 ' HB1' ' A' ' 59' ' ' ALA . 79.6 t -101.12 136.53 32.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.946 0.403 . . . . 0.0 111.041 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 22.2 pt -136.42 135.75 49.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.39 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.437 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 14.8 tp -98.79 104.61 16.66 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.199 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -119.47 138.57 53.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.999 -179.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.82 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.79 0.329 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.6 tttp -159.76 127.83 4.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.876 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.8 mtmm -163.08 97.87 0.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.824 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.514 ' O ' HG23 ' A' ' 4' ' ' THR . 8.3 t -159.01 105.34 1.75 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.871 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.9 m -97.31 87.73 4.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.46 31.41 5.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.901 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.09 163.94 13.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.992 179.899 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.654 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 165.8 157.98 10.44 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.967 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 1.2 mt -143.75 138.33 28.73 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.31 106.85 18.08 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.105 0.479 . . . . 0.0 110.085 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.7 mttp -126.78 154.18 44.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.446 179.83 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.025 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -109.28 135.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.141 179.701 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.8 tt0 -127.68 138.14 52.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.542 0.21 . . . . 0.0 111.07 -179.356 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.612 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -108.16 -4.59 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.923 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.38 176.27 30.24 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 118.609 -1.758 . . . . 0.0 115.352 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.62 143.94 24.07 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 114.596 -0.802 . . . . 0.0 108.999 178.024 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.483 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.1 m-85 -152.95 144.07 23.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.954 0.407 . . . . 0.0 111.635 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.55 -17.29 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.187 179.761 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.4 t -107.28 127.57 62.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.284 0.564 . . . . 0.0 112.175 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 2.0 tmtt? -70.16 -41.78 73.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.634 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.03 -35.51 47.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.301 0.572 . . . . 0.0 109.763 179.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -74.47 -32.8 62.69 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.384 -0.826 . . . . 0.0 109.221 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.72 -27.36 63.92 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.81 179.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.83 -37.32 55.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.577 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -34.31 77.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.196 0.522 . . . . 0.0 109.877 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.99 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.0 tp -69.73 -51.98 29.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.465 179.566 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.408 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.95 -26.41 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.076 0.465 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.2 m -73.95 -40.81 62.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.104 179.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.99 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.3 -49.4 77.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.745 -179.926 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.936 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.85 -39.42 89.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.294 179.542 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.83 -36.21 64.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.2 179.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -50.13 68.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.268 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 2.1 mmtt -62.54 -28.61 69.97 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.731 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.54 33.56 2.87 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.609 179.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.746 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.7 m-85 -101.46 157.6 16.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 110.736 179.564 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.69 93.3 8.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.879 179.254 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.6 ' HA ' HG22 ' A' ' 50' ' ' ILE . 92.6 p -80.5 157.15 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.151 0.501 . . . . 0.0 111.136 -178.707 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.526 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.98 140.07 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.429 -178.768 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.498 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 38.7 t -118.5 116.61 51.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.565 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.775 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -107.22 121.59 44.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.616 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.775 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.5 tp -77.26 108.64 10.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.269 0.557 . . . . 0.0 111.046 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.575 ' CE ' HD12 ' A' ' 45' ' ' LEU . 3.3 tmmm? -91.1 165.48 13.49 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.86 179.49 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 50.4 t0 -61.24 66.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.808 0.337 . . . . 0.0 111.719 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.936 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 118.58 -11.15 12.45 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.808 -0.71 . . . . 0.0 113.535 179.333 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.936 HD23 ' O ' ' A' ' 44' ' ' GLY . 5.9 mt -138.7 148.32 43.82 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 117.464 0.632 . . . . 0.0 112.251 -179.234 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.772 ' CE1' HD13 ' A' ' 41' ' ' LEU . 21.3 m-85 -109.25 127.27 54.13 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.615 178.313 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -107.47 151.82 25.05 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.128 0.489 . . . . 0.0 111.496 -179.713 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.634 HG21 ' HB3' ' A' ' 26' ' ' LEU . 52.7 t -125.77 106.73 16.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.084 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.526 ' HB3' HG23 ' A' ' 38' ' ' ILE . 13.6 tt0 -105.66 141.08 37.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.936 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.6 123.59 42.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.524 0.678 . . . . 0.0 111.392 179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.495 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.59 108.73 0.29 Allowed Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 114.798 -1.092 . . . . 0.0 113.14 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.456 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.56 124.11 26.33 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.508 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -143.2 175.76 9.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 111.599 -179.18 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.6 m -84.52 -18.81 34.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.02 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.38 129.52 55.99 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.888 0.375 . . . . 0.0 111.084 -179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtm? -56.49 -36.87 69.61 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.52 -179.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -50.69 -31.69 17.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.865 0.364 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.458 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 27.3 m-80 -71.34 -49.38 43.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.699 179.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.453 ' HB1' HG13 ' A' ' 75' ' ' VAL . . . -60.62 -43.21 97.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.128 179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.66 -52.05 67.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 110.835 -179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 3.9 m -55.45 -39.87 70.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.025 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -66.86 -50.37 62.72 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.737 0.779 . . . . 0.0 110.59 179.608 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.696 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -52.03 -62.04 1.88 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.382 -177.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.87 -35.2 61.29 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.939 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.1 ttt180 -63.67 -40.59 97.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.003 179.188 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.06 -40.97 95.51 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.741 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 7.9 mttm -61.67 -47.56 84.8 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.653 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -68.7 -25.87 65.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.79 178.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.35 -22.13 52.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.584 179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.35 23.78 5.62 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.586 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.546 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -131.0 149.89 52.41 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.294 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.504 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 9.2 t0 -92.3 73.75 5.33 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.961 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -87.3 140.09 29.89 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.042 0.448 . . . . 0.0 111.887 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 3.1 pt -133.7 153.14 36.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.891 179.07 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.665 HG22 HG13 ' A' ' 12' ' ' VAL . 89.3 t -105.77 138.6 30.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.005 0.431 . . . . 0.0 110.97 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.6 pt -142.22 142.36 27.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.405 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.654 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.7 tp -91.69 107.83 19.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.211 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.01 103.7 16.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.018 -179.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.32 -0.847 . . . . 0.0 111.034 179.794 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.8 ttmt -171.25 -42.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 -179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.11 117.35 2.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.855 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 t -155.65 141.02 17.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m -163.0 134.52 5.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.761 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -106.05 115.25 29.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.976 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.09 -175.93 3.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.964 -179.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.56 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 108.26 163.93 21.04 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.559 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 26.2 mt -143.85 140.61 29.9 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.774 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.501 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 43.8 m-85 -101.53 106.93 18.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.1 0.476 . . . . 0.0 110.017 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.1 mttt -127.98 155.32 44.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.028 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.45 137.82 38.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.364 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.452 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 60.9 tt0 -128.91 135.29 48.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.906 -179.436 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.599 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.79 -4.69 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -178.777 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.26 175.99 29.81 Favored Glycine 0 C--N 1.336 0.553 0 C-N-CA 118.616 -1.754 . . . . 0.0 115.273 178.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.533 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.67 144.37 24.32 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.247 178.06 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.528 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -152.69 144.21 23.4 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.988 0.423 . . . . 0.0 111.51 -179.526 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.91 -16.27 1.76 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.202 179.819 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -108.45 127.88 64.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 112.236 -179.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 4.3 ttpt -69.83 -42.03 74.16 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.636 179.588 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -35.28 49.53 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.183 0.515 . . . . 0.0 109.758 179.108 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -74.6 -33.08 62.54 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.303 178.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.511 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -70.76 -25.76 63.05 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.749 179.091 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -78.16 -36.63 47.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -66.48 -35.4 80.19 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 179.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.993 HD12 ' OD1' ' A' ' 29' ' ' ASN . 19.8 tp -69.02 -52.57 27.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.442 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -56.07 -25.96 47.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.482 . . . . 0.0 110.647 179.043 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.8 t -74.66 -40.4 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.993 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -60.64 -48.9 79.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.62 -179.883 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.945 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.16 -39.63 90.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.157 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.56 -36.1 63.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.279 179.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.67 -51.6 62.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.66 -28.72 70.11 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.746 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.03 34.82 2.47 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.662 178.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.756 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -101.83 159.07 15.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.911 0.386 . . . . 0.0 110.723 179.391 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.44 94.43 9.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.12 179.382 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.562 ' HA ' HG22 ' A' ' 50' ' ' ILE . 83.7 p -80.55 156.83 26.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.223 0.535 . . . . 0.0 110.965 -178.681 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.561 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -156.2 137.87 5.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.511 HG13 ' HB1' ' A' ' 23' ' ' ALA . 19.6 t -116.22 114.43 46.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 0.0 111.567 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.8 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -107.1 122.25 46.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.58 179.665 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.8 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.7 tp -77.6 108.28 10.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.305 0.574 . . . . 0.0 111.175 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' CE ' HD12 ' A' ' 45' ' ' LEU . 3.7 tmmm? -90.76 165.48 13.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.913 179.444 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 35.6 t70 -61.27 66.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 111.661 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.936 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 119.64 -12.17 11.05 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.725 -0.75 . . . . 0.0 113.678 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.936 HD23 ' O ' ' A' ' 44' ' ' GLY . 4.9 mt -139.19 150.48 45.62 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 117.479 0.64 . . . . 0.0 112.452 -179.29 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.761 ' CE1' HD13 ' A' ' 41' ' ' LEU . 22.0 m-85 -109.75 128.06 55.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.518 178.282 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.496 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -107.79 151.7 25.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.183 0.516 . . . . 0.0 111.512 -179.557 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.675 ' HB ' HD23 ' A' ' 26' ' ' LEU . 51.0 t -125.45 105.53 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.068 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.561 ' HB3' HG23 ' A' ' 38' ' ' ILE . 7.5 tt0 -104.3 141.54 36.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.945 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.57 123.57 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 121.46 0.647 . . . . 0.0 111.593 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.528 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.37 107.38 0.23 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.208 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.487 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -131.96 123.46 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.529 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.34 175.16 9.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.176 0.512 . . . . 0.0 111.649 -179.224 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.5 p -83.43 -18.75 37.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.009 179.743 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -111.49 129.32 56.08 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.955 0.407 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -55.49 -35.9 66.07 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.258 -179.876 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -50.21 -32.62 16.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.887 0.375 . . . . 0.0 111.043 -179.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.453 ' CB ' ' CG ' ' A' ' 53' ' ' PHE . 9.5 m120 -70.79 -50.15 38.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.551 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.66 -44.72 93.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.169 179.819 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -57.57 -52.84 63.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 0.0 110.884 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 24.9 m -55.67 -38.94 70.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.908 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.028 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.02 -51.08 59.3 Favored 'General case' 0 CA--C 1.505 -0.776 0 CA-C-O 121.788 0.804 . . . . 0.0 110.475 179.556 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.661 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.24 -61.56 2.22 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.279 -177.573 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.81 -36.91 49.57 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -63.63 -39.54 94.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.859 179.141 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.94 -41.85 90.79 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.732 179.032 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 10.5 mttm -61.14 -48.27 82.39 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.18 -25.99 65.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.803 178.559 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.493 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.77 -21.04 52.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.497 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.34 24.21 5.74 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.518 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.561 ' HB2' ' HB1' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.35 149.81 52.4 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.162 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.5 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 46.3 t0 -92.8 73.61 4.92 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.943 -0.303 . . . . 0.0 110.965 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.85 139.28 31.41 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.06 0.457 . . . . 0.0 111.747 179.888 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.7 pt -132.82 149.76 32.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.161 179.089 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.551 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.4 t -101.88 137.22 30.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.93 0.395 . . . . 0.0 111.017 179.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.3 pt -138.49 139.12 41.99 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.237 -179.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.56 HD11 ' HA3' ' A' ' 8' ' ' GLY . 15.3 tp -96.83 107.97 20.56 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.244 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -135.07 132.97 38.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.893 -179.999 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.792 0.329 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.67 -179.36 6.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.872 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.04 -48.35 0.45 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.9 t -101.65 127.8 48.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.841 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.17 -44.1 2.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.917 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.7 t -89.85 123.07 33.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.905 179.957 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.84 128.18 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 179.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.492 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -64.18 143.87 47.92 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.493 179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 18.0 mt -143.86 138.96 29.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.512 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 47.3 m-85 -100.93 106.77 18.13 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.117 0.484 . . . . 0.0 110.058 179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -125.98 154.78 42.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.591 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.99 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -108.48 138.84 33.32 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.151 179.706 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.435 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 6.7 tt0 -131.35 135.43 47.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.684 0.278 . . . . 0.0 110.985 -179.211 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.693 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -107.45 -5.41 10.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.85 175.68 30.05 Favored Glycine 0 C--N 1.338 0.664 0 C-N-CA 118.772 -1.68 . . . . 0.0 115.285 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -151.61 142.95 23.41 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.046 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.569 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.6 m-85 -153.06 144.17 23.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.015 0.436 . . . . 0.0 111.625 -179.348 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.4 OUTLIER -53.93 -16.16 1.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.02 179.761 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.03 126.7 64.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 3.9 ttpt -69.39 -41.28 76.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.381 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.87 -34.28 53.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.249 0.547 . . . . 0.0 109.647 179.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.74 -33.09 62.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.161 178.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.9 -18.64 60.88 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.016 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.92 -38.62 20.83 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.67 179.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.2 t -67.52 -37.54 82.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.284 0.564 . . . . 0.0 109.524 178.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.846 HD12 ' ND2' ' A' ' 29' ' ' ASN . 54.3 tp -65.67 -51.91 55.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.992 179.341 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.501 ' HB1' ' CB ' ' A' ' 37' ' ' SER . . . -59.06 -24.21 62.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.611 179.238 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.41 -40.55 70.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.28 179.45 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.846 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.76 -48.44 81.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.659 179.787 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.937 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -58.53 -42.81 88.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.519 -179.871 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -55.12 -37.23 66.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.151 179.778 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.13 -51.25 64.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.361 179.395 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 14.6 mmtt -62.64 -28.86 70.21 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.67 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 110.22 33.56 2.51 Favored Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.752 178.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.2 m-85 -104.22 164.22 11.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.924 0.392 . . . . 0.0 110.594 179.379 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.55 92.52 8.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.939 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.681 ' HA ' HG22 ' A' ' 50' ' ' ILE . 4.5 m -81.22 127.37 32.61 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.288 0.566 . . . . 0.0 111.178 -178.794 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.563 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -124.61 139.04 52.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.671 -179.217 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 22.9 t -116.04 113.11 42.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.196 179.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.79 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -106.4 122.23 45.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.88 179.809 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.79 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.7 tp -77.37 108.03 10.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.144 0.497 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 44' ' ' GLY . 4.3 tmmm? -90.59 165.39 13.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.821 179.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.486 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 1.4 t0 -60.62 66.28 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.774 -179.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.935 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 121.6 -16.75 8.98 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.667 179.217 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.935 HD23 ' O ' ' A' ' 44' ' ' GLY . 4.2 mt -136.66 152.81 50.82 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 117.495 0.648 . . . . 0.0 112.425 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.739 ' CE1' HD13 ' A' ' 41' ' ' LEU . 22.8 m-85 -109.75 129.28 55.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.544 178.201 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -109.76 151.78 26.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.099 0.476 . . . . 0.0 111.42 -179.633 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.693 HG12 HD11 ' A' ' 14' ' ' ILE . 67.5 t -124.03 105.41 15.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.011 179.792 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HB3' HG23 ' A' ' 38' ' ' ILE . 8.4 tt0 -104.63 141.44 36.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.516 179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.937 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.6 pp -135.48 123.1 36.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.431 0.634 . . . . 0.0 111.668 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 81.39 108.13 0.35 Allowed Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.945 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.468 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -130.48 122.27 27.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.519 0.199 . . . . 0.0 110.468 179.586 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -142.47 172.64 12.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.47 . . . . 0.0 111.518 -179.295 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 t -82.87 -16.81 46.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.059 179.748 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -112.83 129.9 56.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.013 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.512 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.0 tmtt? -56.77 -35.31 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.264 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -50.32 -32.97 18.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 110.928 -179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.455 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 24.4 m-80 -70.71 -49.59 45.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.725 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.46 -42.93 93.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.117 179.801 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -58.84 -52.15 66.97 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 111.106 -179.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -58.18 -35.79 72.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.921 -179.93 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.99 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.49 -51.51 35.28 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-O 121.757 0.789 . . . . 0.0 110.188 179.561 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.72 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.62 -60.62 3.1 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.064 -177.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.85 51.55 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.663 179.53 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.411 ' HB2' ' O ' ' A' ' 61' ' ' THR . 4.6 ttt180 -63.1 -38.16 90.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.814 178.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.68 -41.99 91.78 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.723 179.085 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 43.4 mttm -61.39 -47.59 85.13 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.621 178.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -68.91 -25.44 64.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.69 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.43 -21.96 52.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.392 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.78 24.2 5.63 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.375 -179.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.542 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.1 m-85 -130.78 149.09 52.58 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -179.214 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 11.6 t70 -92.25 71.89 5.33 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.064 -0.255 . . . . 0.0 110.695 179.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.731 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.25 141.39 30.14 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-O 121.09 0.471 . . . . 0.0 111.731 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.1 pt -134.08 152.62 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 179.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.572 HG22 ' HB1' ' A' ' 59' ' ' ALA . 94.0 t -104.73 135.19 43.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.875 0.369 . . . . 0.0 110.953 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt -137.7 140.57 41.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.36 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.492 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.3 tp -94.74 106.07 18.04 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.19 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -94.17 111.0 22.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 -179.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.901 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.8 mt . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.873 0.368 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -106.72 106.06 16.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.844 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -100.39 31.93 3.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.889 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 78.0 p -75.26 168.69 19.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.2 p -116.6 38.41 3.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.6 t -108.19 135.97 48.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.882 179.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 72.6 m -76.31 169.52 18.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.981 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.636 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . 161.07 171.2 26.74 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.636 179.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 81.7 mt -143.86 141.25 30.23 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.713 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.523 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.8 m-85 -101.25 107.28 18.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.109 0.48 . . . . 0.0 109.974 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 8.3 mttm -126.08 155.37 41.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.4 179.802 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.999 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -109.07 137.49 40.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.212 179.811 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 1.5 tt0 -128.44 133.4 48.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.675 0.274 . . . . 0.0 111.409 -179.357 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.935 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -98.6 -5.61 9.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -179.13 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 151.31 -176.49 29.75 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 119.037 -1.554 . . . . 0.0 114.813 178.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.534 ' HA ' ' O ' ' A' ' 46' ' ' TYR . . . -152.35 144.41 23.81 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 114.929 -0.636 . . . . 0.0 109.428 178.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.501 ' HE2' HD22 ' A' ' 26' ' ' LEU . 16.7 m-85 -153.22 141.89 20.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.914 0.388 . . . . 0.0 111.532 -179.595 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.1 OUTLIER -53.22 -15.57 0.97 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.892 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 t -107.35 123.31 62.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 121.076 0.465 . . . . 0.0 112.165 -179.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -67.19 -41.03 86.55 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.23 179.262 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.43 -31.89 47.33 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.205 0.526 . . . . 0.0 109.704 178.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -76.42 -32.38 58.44 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.263 178.336 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -77.21 -17.25 58.64 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.095 179.086 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -84.47 -38.68 19.84 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -72.79 -33.49 66.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.339 0.59 . . . . 0.0 109.719 178.917 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.726 HD12 ' ND2' ' A' ' 29' ' ' ASN . 12.0 tp -66.86 -56.89 8.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.482 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.676 ' HB2' HG13 ' A' ' 48' ' ' VAL . . . -56.75 -33.66 66.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.149 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 m -61.27 -40.88 95.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.41 179.614 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.726 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -61.38 -43.38 98.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.45 179.655 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.95 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -61.39 -41.98 98.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.11 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -55.04 -35.99 65.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.137 179.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.4 -51.48 64.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.277 179.371 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 8.5 mmtt -62.63 -28.55 69.98 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.9 33.46 2.6 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.3 -0.863 . . . . 0.0 112.775 178.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.766 ' CG ' HD11 ' A' ' 62' ' ' LEU . 4.6 m-85 -102.37 158.92 15.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.917 0.389 . . . . 0.0 110.904 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.56 92.72 8.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.738 179.22 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.634 ' HA ' HG22 ' A' ' 50' ' ' ILE . 16.1 p -80.69 158.52 25.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.191 0.519 . . . . 0.0 111.339 -178.642 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.544 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.82 141.71 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.479 -178.818 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.419 HG13 ' HB1' ' A' ' 23' ' ' ALA . 23.6 t -118.84 115.84 49.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.513 -179.788 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -108.68 123.68 49.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.455 179.585 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.816 ' N ' HD12 ' A' ' 40' ' ' LEU . 1.9 tp -78.07 108.8 11.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 110.978 179.909 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.551 ' O ' ' N ' ' A' ' 44' ' ' GLY . 4.0 tmmm? -91.17 165.61 13.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.901 179.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 6.4 t0 -61.17 65.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.854 0.359 . . . . 0.0 111.795 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.927 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 121.21 -15.72 9.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.787 -0.72 . . . . 0.0 113.579 179.307 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.927 HD23 ' O ' ' A' ' 44' ' ' GLY . 4.0 mt -136.27 149.71 48.6 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 117.423 0.612 . . . . 0.0 112.496 -179.234 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.744 ' CE1' HD13 ' A' ' 41' ' ' LEU . 22.9 m-85 -108.31 126.53 52.94 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.674 -0.693 . . . . 0.0 109.284 178.316 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.74 148.94 27.83 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.238 0.542 . . . . 0.0 111.752 -179.362 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.935 HG12 HD11 ' A' ' 14' ' ' ILE . 61.9 t -120.31 106.17 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 115.111 -0.949 . . . . 0.0 110.919 179.683 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.544 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.3 tt0 -105.57 139.89 39.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.001 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.95 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.88 124.03 36.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.459 0.647 . . . . 0.0 111.64 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.477 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.21 108.99 0.28 Allowed Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 114.846 -1.07 . . . . 0.0 113.197 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.445 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -133.12 115.49 15.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.682 0.277 . . . . 0.0 110.425 179.556 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.55 175.93 8.99 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.057 0.456 . . . . 0.0 111.564 -179.256 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 26.0 p -84.56 -18.29 36.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.023 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.43 128.71 56.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.865 0.364 . . . . 0.0 111.105 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 2.5 tmtm? -55.59 -36.42 66.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.259 -179.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -51.65 -32.01 27.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.925 0.393 . . . . 0.0 110.955 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.448 ' HB3' ' CG ' ' A' ' 53' ' ' PHE . 4.1 m120 -70.67 -49.5 46.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.732 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.563 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.77 -41.66 91.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.082 179.656 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -59.14 -51.5 69.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.994 -179.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -36.71 71.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.832 179.89 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.999 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.46 -50.64 43.58 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 121.667 0.746 . . . . 0.0 110.15 179.543 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.753 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.44 -60.57 3.14 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.06 -177.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.66 -37.42 58.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.709 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 3.8 ttt180 -63.82 -38.51 91.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 0.0 109.804 179.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.3 -41.75 93.77 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.759 179.114 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.1 OUTLIER -62.0 -46.5 88.94 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.614 178.841 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -68.88 -25.79 64.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.642 178.253 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.85 -21.95 54.26 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.266 179.608 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.01 24.12 5.87 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.936 -0.649 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.527 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 0.9 OUTLIER -130.56 152.14 50.26 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.139 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 17.9 t70 -94.47 71.35 3.71 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.949 -0.301 . . . . 0.0 111.199 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.798 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -88.81 140.5 29.38 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 121.062 0.458 . . . . 0.0 111.667 179.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 13.7 pt -134.21 157.66 41.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.837 179.259 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.563 HG22 ' HB1' ' A' ' 59' ' ' ALA . 97.1 t -105.23 137.24 35.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.918 0.389 . . . . 0.0 111.158 179.888 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.5 pt -141.45 142.37 29.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.393 -179.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.636 HD11 ' HA3' ' A' ' 8' ' ' GLY . 14.0 tp -93.72 107.24 19.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.241 179.784 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -104.38 136.84 43.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.095 -179.623 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.4 p . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.882 179.826 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.875 0.369 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -169.92 95.1 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.914 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -69.11 0.3 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.5 m 60.85 101.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 179.963 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -104.38 -70.35 0.77 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.941 -179.948 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.1 p -177.74 175.81 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.903 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.63 -50.03 8.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -123.45 -145.01 6.71 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.374 -179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 14.7 mt -144.01 140.66 29.7 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 44.7 m-85 -101.4 106.8 17.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.011 0.434 . . . . 0.0 109.86 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.83 153.5 46.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.495 179.968 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.078 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.82 139.26 27.59 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.335 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.388 -179.942 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -130.42 137.52 49.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.586 0.232 . . . . 0.0 111.222 -179.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.701 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -109.92 -6.23 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -178.89 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.59 175.02 30.08 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 118.713 -1.708 . . . . 0.0 115.355 178.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.498 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.44 145.37 25.18 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 114.554 -0.823 . . . . 0.0 109.031 178.141 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.571 ' HE1' HD22 ' A' ' 26' ' ' LEU . 2.6 m-85 -153.28 148.22 26.57 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.929 0.395 . . . . 0.0 111.611 -179.188 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 1.7 tttt -55.61 -17.23 5.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.732 179.703 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.6 t -108.65 129.88 62.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.019 0.438 . . . . 0.0 111.948 -179.487 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -73.74 -37.68 65.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.312 179.612 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.43 64.23 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.297 0.57 . . . . 0.0 109.527 178.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -72.99 -32.15 64.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.986 178.107 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.44 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -73.4 -20.0 60.85 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.805 179.055 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -82.11 -37.33 26.46 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.726 179.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.5 t -69.35 -35.93 76.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.796 179.037 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.844 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -66.39 -51.75 53.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.358 179.393 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.614 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.75 -27.85 65.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.097 0.475 . . . . 0.0 110.417 179.072 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 t -67.7 -41.58 83.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.599 179.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.844 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -60.06 -47.63 85.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.622 179.651 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.902 ' HB1' HG21 ' A' ' 50' ' ' ILE . . . -60.64 -41.77 95.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.525 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -54.54 -36.36 64.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.244 179.587 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 29' ' ' ASN . . . -54.41 -51.4 65.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.429 179.472 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 10.9 mmtt -62.67 -28.81 70.18 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.678 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.01 34.63 2.52 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.636 178.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.72 ' CD2' HD11 ' A' ' 62' ' ' LEU . 5.3 m-85 -102.66 159.44 15.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.899 0.381 . . . . 0.0 110.802 179.631 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -87.6 93.82 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.252 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.614 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 41.2 p -79.02 152.87 30.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.973 -178.957 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.612 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.4 OUTLIER -152.29 135.0 6.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.525 -178.706 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 12.0 t -111.87 112.05 38.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.32 -179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.841 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -110.19 125.16 52.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.674 179.737 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.841 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -78.01 102.97 7.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.34 0.591 . . . . 0.0 111.191 -179.918 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.709 ' HB2' ' CE ' ' A' ' 47' ' ' LYS . 1.2 tmmm? -91.28 120.41 32.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.002 179.019 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.481 ' HB3' ' HD2' ' A' ' 42' ' ' LYS . 38.8 t70 47.11 -84.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.765 0.317 . . . . 0.0 110.822 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.564 ' N ' ' O ' ' A' ' 42' ' ' LYS . . . -132.38 -0.53 4.53 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.222 178.911 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' ' 41' ' ' LEU . 2.0 mt -110.42 167.0 10.54 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-O 120.903 0.382 . . . . 0.0 110.736 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.692 ' OH ' HD22 ' A' ' 41' ' ' LEU . 25.5 m-85 -119.09 137.79 53.33 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.704 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.709 ' CE ' ' HB2' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -116.27 154.08 30.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.983 0.42 . . . . 0.0 111.067 -179.62 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.701 HG12 HD11 ' A' ' 14' ' ' ILE . 91.7 t -122.95 117.51 52.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.976 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.612 ' HB3' HG23 ' A' ' 38' ' ' ILE . 10.1 tt0 -119.15 143.99 46.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.344 -179.136 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.902 HG21 ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -137.28 140.87 41.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.971 178.993 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.469 ' HA3' ' HG ' ' A' ' 62' ' ' LEU . . . 69.38 97.14 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.971 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -124.89 112.52 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 179.166 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -135.89 171.05 15.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 111.633 -178.802 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -79.44 -16.42 56.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.767 179.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.01 132.14 56.69 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.913 0.387 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.499 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 21.8 ttpt -58.48 -36.74 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.42 -179.808 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -46.71 -32.76 3.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.462 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 5.5 m120 -71.75 -50.08 33.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.74 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.609 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.2 -43.31 82.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.02 179.523 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.58 -51.17 71.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.798 0.332 . . . . 0.0 110.837 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -57.93 -38.57 76.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.848 179.957 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.078 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -67.82 -52.23 39.34 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 121.727 0.775 . . . . 0.0 110.395 179.509 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.671 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.04 -60.73 2.91 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.322 -1.308 . . . . 0.0 111.18 -177.808 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -51.95 -36.39 49.14 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.467 179.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.9 ttt180 -65.54 -39.89 92.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.047 179.035 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.82 -41.52 95.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.591 179.113 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.54 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.4 mttm -61.87 -47.31 85.61 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 178.661 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -69.43 -25.12 63.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.703 178.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.497 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.63 -22.11 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.299 179.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.33 23.09 5.88 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.843 -0.694 . . . . 0.0 111.418 -179.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.14 148.14 51.95 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 -179.248 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.442 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -91.8 74.43 5.73 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.772 179.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.81 140.92 29.22 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.129 0.49 . . . . 0.0 111.855 179.981 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.623 HD12 HG23 ' A' ' 76' ' ' ILE . 1.9 pp -133.49 151.46 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.957 179.196 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.609 HG22 ' HB1' ' A' ' 59' ' ' ALA . 96.7 t -101.54 136.22 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.846 0.355 . . . . 0.0 110.955 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.623 HG23 HD12 ' A' ' 74' ' ' ILE . 18.6 pt -138.95 139.16 40.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.244 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 16.7 tp -94.19 107.61 19.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.31 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -94.45 121.37 35.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.185 -179.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.914 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.841 0.353 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm 61.88 179.41 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.855 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -83.48 129.63 34.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.99 179.95 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.5 t 43.49 73.46 0.14 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.26 36.41 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.81 120.9 21.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.7 p -71.04 -168.9 0.32 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.977 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -105.22 -145.95 14.17 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.524 179.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 4.0 mt -143.5 139.16 29.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 179.798 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CE1' HD13 ' A' ' 77' ' ' LEU . 43.5 m-85 -101.28 106.01 17.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.115 0.483 . . . . 0.0 110.163 179.681 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.46 153.38 43.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.359 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.004 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.55 141.55 20.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.379 179.84 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -133.73 132.74 40.95 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.728 0.299 . . . . 0.0 111.243 -178.945 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.559 HD11 HG12 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -106.08 -5.9 10.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.057 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.96 173.02 29.06 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 118.951 -1.595 . . . . 0.0 114.778 179.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.53 ' HA ' ' HA ' ' A' ' 47' ' ' LYS . . . -151.03 137.26 18.42 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 114.986 -0.607 . . . . 0.0 109.625 178.45 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.596 ' HE1' HD22 ' A' ' 26' ' ' LEU . 1.3 m-85 -146.29 150.54 35.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.873 0.368 . . . . 0.0 111.102 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 30.6 ttmt -61.31 -12.91 15.51 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.937 -179.87 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.5 t -108.36 129.46 62.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.011 0.434 . . . . 0.0 111.965 -179.402 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 1.7 ttpt -71.4 -40.1 70.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.579 179.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.15 -33.62 58.42 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.301 0.572 . . . . 0.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -76.48 -32.03 58.11 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.354 178.349 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.613 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -74.04 -20.6 60.25 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.999 179.271 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.91 -38.47 21.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.693 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -67.34 -36.71 81.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.199 0.523 . . . . 0.0 109.696 179.104 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.817 HD12 ' ND2' ' A' ' 29' ' ' ASN . 50.9 tp -67.2 -51.57 51.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.253 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.573 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -58.57 -24.4 60.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.369 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.89 -41.66 67.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.559 179.581 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.817 ' ND2' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -59.13 -47.06 86.67 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.391 179.816 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.955 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -60.74 -40.76 93.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.668 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -55.13 -36.91 66.27 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.203 179.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.42 -51.35 62.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.24 179.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.542 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.7 OUTLIER -62.48 -28.6 69.94 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.673 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 109.06 32.35 3.07 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.542 179.111 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.792 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.1 m-85 -100.5 156.77 17.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.897 0.38 . . . . 0.0 110.776 179.506 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -85.27 93.63 8.73 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.66 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.626 ' HA ' HG22 ' A' ' 50' ' ' ILE . 54.1 p -80.16 156.76 26.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.076 0.465 . . . . 0.0 111.107 -178.638 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -157.13 139.13 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.716 -178.641 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.613 HG13 ' HB1' ' A' ' 23' ' ' ALA . 24.0 t -113.75 110.72 33.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.18 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.823 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -105.51 122.95 47.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.008 0.432 . . . . 0.0 110.663 179.798 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.823 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.0 tp -86.76 111.62 20.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.089 179.889 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.706 ' HE2' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -92.38 166.18 12.7 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.358 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.484 ' N ' ' HD2' ' A' ' 42' ' ' LYS . 3.9 t70 -57.87 67.35 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.855 ' O ' HD23 ' A' ' 45' ' ' LEU . . . 134.03 -21.78 3.88 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.64 178.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.855 HD23 ' O ' ' A' ' 44' ' ' GLY . 36.9 mt -143.37 166.38 24.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 117.865 0.832 . . . . 0.0 112.504 -179.055 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.61 ' OH ' HD22 ' A' ' 41' ' ' LEU . 26.1 m-85 -114.79 138.75 50.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.565 178.402 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.53 ' HA ' ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -120.49 157.18 29.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.031 0.443 . . . . 0.0 111.338 -179.836 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.707 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.5 t -124.67 110.99 26.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.407 -179.701 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.1 tt0 -110.24 141.01 43.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.422 179.821 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.955 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.11 123.1 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.45 0.643 . . . . 0.0 111.652 179.702 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.527 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 80.13 100.13 0.3 Allowed Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.9 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.25 123.18 40.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.369 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -142.8 170.25 16.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.122 0.486 . . . . 0.0 111.501 -179.112 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.5 p -80.47 -16.4 54.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.903 179.537 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.55 131.05 56.79 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.893 0.378 . . . . 0.0 110.95 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.501 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 19.5 ttpp -57.52 -36.74 71.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.404 -179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -46.43 -32.17 3.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.977 0.418 . . . . 0.0 110.917 -179.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.584 ' O ' HG22 ' A' ' 61' ' ' THR . 7.9 m120 -73.79 -48.7 29.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.356 179.647 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.579 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.78 -45.62 91.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.132 179.653 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -59.07 -53.07 62.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.702 0.287 . . . . 0.0 111.22 -179.649 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.584 HG22 ' O ' ' A' ' 58' ' ' ASN . 14.8 t -58.87 -34.4 71.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.938 0.399 . . . . 0.0 111.034 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.004 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.85 -52.95 20.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 121.87 0.843 . . . . 0.0 110.195 179.522 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.745 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.73 -58.49 7.01 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 114.143 -1.39 . . . . 0.0 110.97 -177.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.96 -37.28 60.99 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.468 179.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 61' ' ' THR . 3.2 ttt180 -64.16 -39.06 93.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.764 178.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.03 -40.44 96.33 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.45 179.075 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.02 91.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.556 178.741 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -70.25 -25.51 63.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.878 178.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB2' ' HD2' ' A' ' 33' ' ' LYS . . . -77.17 -22.96 51.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.374 179.784 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 112.31 23.67 5.38 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.547 -179.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.547 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.22 148.28 52.69 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 -179.245 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.3 t0 -92.31 73.72 5.32 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.779 179.594 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.704 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -84.96 142.86 29.34 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.082 0.468 . . . . 0.0 111.806 -179.869 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 16.2 pt -134.66 153.06 34.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 179.11 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.579 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.1 t -103.75 135.38 41.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 111.073 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.6 tt -134.94 135.72 52.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.225 -179.909 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.526 HD13 ' CE1' ' A' ' 10' ' ' TYR . 15.3 tp -99.76 104.19 15.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.037 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -99.88 132.0 45.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.922 0.392 . . . . 0.0 111.201 -179.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.9 p . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.847 179.921 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 1' ' ' LEU . 3.1 mm? . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.836 0.35 . . . . 0.0 111.204 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -135.11 143.53 46.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.956 179.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 mttp 60.09 90.52 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.96 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.8 m -129.06 154.48 46.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.889 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -134.88 -46.7 0.73 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.917 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.3 106.11 18.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.886 179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 t -164.17 -176.86 4.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.924 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.536 ' HA3' HD11 ' A' ' 77' ' ' LEU . . . -170.79 167.1 40.28 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.629 -179.984 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 9.7 mt -143.92 141.69 30.38 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 179.73 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.506 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 49.3 m-85 -101.76 106.97 18.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.163 0.506 . . . . 0.0 109.937 179.582 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.402 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 1.3 mttt -125.93 152.88 45.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.349 179.784 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.011 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -104.23 142.57 17.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.171 179.778 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -135.51 134.19 39.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.853 0.359 . . . . 0.0 111.423 -178.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.531 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.23 -5.65 10.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -179.328 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.78 173.97 27.88 Favored Glycine 0 C--N 1.338 0.672 0 C-N-CA 119.215 -1.469 . . . . 0.0 114.421 179.009 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.761 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.65 147.95 27.36 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.092 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.566 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.2 m-85 -152.22 151.64 31.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.989 0.423 . . . . 0.0 111.268 -179.384 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 6.2 pttp -60.89 -14.36 21.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.345 179.521 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.93 128.43 61.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.955 0.407 . . . . 0.0 111.76 -179.75 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -71.8 -36.86 70.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.247 179.639 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.16 -32.6 70.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 109.779 178.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -76.98 -34.33 57.56 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.109 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.449 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.54 -19.39 61.52 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.659 178.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -83.73 -38.29 21.57 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.345 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.0 t -65.28 -37.03 85.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.309 0.576 . . . . 0.0 109.644 178.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.931 HD12 ' OD1' ' A' ' 29' ' ' ASN . 40.3 tp -67.91 -48.7 65.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.137 179.172 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.62 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -57.35 -26.22 60.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.143 0.497 . . . . 0.0 110.369 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.24 -40.45 62.39 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.07 179.728 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.931 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.32 -48.55 81.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.939 0.4 . . . . 0.0 110.633 -179.977 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.956 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.46 -38.35 89.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.276 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.84 -36.64 65.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.416 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.71 -51.42 60.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.524 179.546 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.34 -28.04 69.48 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.804 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.28 33.63 2.91 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.491 179.025 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.801 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.7 m-85 -101.0 157.96 16.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.687 179.356 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.37 95.92 9.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.144 179.634 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.62 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 54.7 p -80.36 155.2 27.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.17 0.51 . . . . 0.0 110.973 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.631 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.66 139.96 8.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.783 -178.643 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.594 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.2 t -117.34 116.4 51.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.497 -179.712 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.883 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -119.18 130.12 55.34 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.904 0.383 . . . . 0.0 110.337 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.883 ' N ' HD12 ' A' ' 40' ' ' LEU . 8.5 tp -90.79 115.02 27.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.01 -179.498 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.714 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.6 OUTLIER -106.16 151.94 24.09 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.372 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.468 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 30.85 -82.11 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 O-C-N 123.206 0.316 . . . . 0.0 111.154 -179.804 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.78 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -145.75 25.47 1.8 Allowed Glycine 0 CA--C 1.523 0.59 0 C-N-CA 121.288 -0.482 . . . . 0.0 111.923 178.948 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.78 HD23 ' O ' ' A' ' 44' ' ' GLY . 16.1 mt -132.02 161.54 32.93 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.989 0.424 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.642 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 27.4 m-85 -115.51 135.94 53.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.252 178.918 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.761 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.71 148.42 30.48 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 120.996 0.427 . . . . 0.0 111.114 -179.912 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.73 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.0 t -120.03 99.08 6.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.648 179.606 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' HG23 ' A' ' 38' ' ' ILE . 0.8 OUTLIER -102.56 140.84 36.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.701 -179.62 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.956 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -134.01 123.05 43.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 111.324 179.623 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 78.28 103.56 0.2 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 114.862 -1.063 . . . . 0.0 112.819 179.897 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' HB1' ' HG2' ' A' ' 11' ' ' LYS . . . -125.43 124.41 41.4 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -141.35 174.38 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.088 0.471 . . . . 0.0 111.606 -179.363 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.17 -17.27 43.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.984 179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.6 t -112.6 128.73 56.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.506 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 3.5 tmtt? -56.68 -34.69 67.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.225 -179.881 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.51 -32.66 28.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.853 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 79.7 m-20 -70.49 -49.52 47.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.65 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.585 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -59.2 -41.56 88.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.91 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.95 -51.15 70.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.8 0.333 . . . . 0.0 110.804 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 2.0 m -58.66 -35.89 73.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 -180.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.011 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.07 -51.56 30.9 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 121.766 0.793 . . . . 0.0 110.161 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.743 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.65 -58.49 7.01 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.938 -177.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.59 -36.76 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.02 -38.87 92.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.559 178.937 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.18 -40.75 94.67 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.476 178.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 49.9 mttm -62.07 -47.21 85.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.624 178.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -68.68 -25.89 65.02 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.66 178.52 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -77.11 -21.94 53.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.394 -179.98 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.07 23.45 5.82 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.409 -179.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.576 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.86 148.55 52.64 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.354 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.4 t0 -92.21 74.52 5.4 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.708 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.08 142.29 28.81 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.082 0.468 . . . . 0.0 112.003 179.89 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 10.1 pt -135.53 153.09 32.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.062 179.177 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HB1' ' A' ' 59' ' ' ALA . 98.3 t -103.04 135.94 38.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.903 0.382 . . . . 0.0 110.914 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.2 tt -138.8 139.9 39.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.153 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.536 HD11 ' HA3' ' A' ' 8' ' ' GLY . 13.6 tp -94.59 105.82 17.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.138 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -99.13 125.0 44.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.172 -179.651 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.959 179.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.744 0.307 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -90.2 -59.39 2.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.802 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -121.2 165.28 15.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.962 179.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.7 175.27 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.863 179.917 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 106.94 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.942 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.2 m -128.24 23.43 6.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.133 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.1 m 54.32 -179.04 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.927 0.394 . . . . 0.0 111.109 179.95 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -117.9 -143.39 7.37 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.377 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 77' ' ' LEU . 22.6 mt -144.11 139.74 29.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.491 ' CD2' ' N ' ' A' ' 56' ' ' LYS . 42.4 m-85 -101.04 106.73 18.04 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.423 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -126.51 155.85 41.69 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.532 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.056 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -107.68 138.28 34.77 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.29 179.845 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -130.49 134.98 47.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.767 0.318 . . . . 0.0 111.104 -179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.559 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.27 -5.25 10.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.145 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 162.62 171.15 28.45 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 119.15 -1.5 . . . . 0.0 114.687 179.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -150.62 140.95 22.33 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.476 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.526 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.6 m-85 -149.85 149.62 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.0 111.361 -179.323 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -60.14 -15.41 23.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.525 179.843 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.0 t -104.93 128.66 58.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.041 0.448 . . . . 0.0 111.765 -179.711 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 46' ' ' TYR . 0.2 OUTLIER -71.84 -38.92 70.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.452 179.772 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -32.39 65.24 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.168 0.509 . . . . 0.0 109.85 179.153 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.68 -33.86 53.15 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.25 178.511 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.53 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -71.8 -22.48 61.57 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.806 179.116 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -81.66 -38.83 25.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -64.0 -37.54 87.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.319 0.58 . . . . 0.0 109.72 179.021 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.959 HD12 ' OD1' ' A' ' 29' ' ' ASN . 27.5 tp -67.62 -46.33 72.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.206 179.357 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.538 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.49 -26.35 65.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.119 0.485 . . . . 0.0 110.631 179.187 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -74.82 -40.62 60.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.071 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.959 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -59.72 -48.58 81.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.911 0.386 . . . . 0.0 110.747 -179.963 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.96 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.61 -38.3 89.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.333 179.472 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -55.18 -36.61 66.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.481 179.613 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.5 -50.29 65.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.388 179.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 6.1 mmtt -62.4 -28.26 69.66 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.709 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.55 32.65 3.1 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.554 179.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.773 ' CG ' HD11 ' A' ' 62' ' ' LEU . 6.2 m-85 -100.89 156.8 17.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.93 0.395 . . . . 0.0 110.72 179.639 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -84.52 94.19 8.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.009 179.422 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.57 ' HA ' HG22 ' A' ' 50' ' ' ILE . 86.3 p -80.24 155.98 27.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.114 0.483 . . . . 0.0 110.968 -178.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.568 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.8 OUTLIER -158.22 142.33 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.761 -178.525 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 35.4 t -120.21 117.86 54.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.366 -179.759 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.75 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -118.5 133.95 55.47 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.981 0.42 . . . . 0.0 110.572 179.681 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.824 HD22 ' CZ ' ' A' ' 46' ' ' TYR . 15.0 tp -93.81 115.54 27.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.141 -179.436 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.683 ' CE ' ' HG ' ' A' ' 45' ' ' LEU . 0.5 OUTLIER -102.69 161.22 13.91 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.476 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.636 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 16.7 -82.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.818 0.342 . . . . 0.0 111.159 -179.492 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.735 ' O ' HD23 ' A' ' 45' ' ' LEU . . . -141.21 26.31 2.46 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.004 178.569 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.792 ' O ' HD12 ' A' ' 41' ' ' LEU . 19.7 mt -130.61 156.86 44.16 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.016 0.436 . . . . 0.0 111.429 -179.83 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.824 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 31.0 m-85 -113.02 132.7 55.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.324 178.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.816 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -106.48 149.45 27.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.983 0.421 . . . . 0.0 111.528 -179.85 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.814 ' HB ' HD23 ' A' ' 26' ' ' LEU . 85.9 t -121.81 100.97 9.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.29 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HB3' HG23 ' A' ' 38' ' ' ILE . 14.1 tt0 -106.84 141.9 37.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.543 -178.831 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.96 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.8 pp -134.78 123.48 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 CA-C-O 121.469 0.652 . . . . 0.0 111.414 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.69 105.33 0.25 Allowed Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.004 179.671 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -128.44 115.49 18.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.628 0.252 . . . . 0.0 110.429 179.525 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.48 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.56 171.04 14.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.045 0.45 . . . . 0.0 111.544 -179.328 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.99 -18.33 50.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.823 179.771 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.02 133.05 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.934 0.397 . . . . 0.0 111.089 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.491 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 7.7 ttpt -58.82 -38.27 78.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.443 -179.708 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -46.01 -32.23 2.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.998 0.427 . . . . 0.0 110.839 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.45 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 65.3 m-80 -72.52 -49.23 34.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.413 179.638 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.637 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.97 -44.66 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.255 179.657 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -59.17 -50.78 72.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 4.6 m -58.9 -36.23 74.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.793 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.056 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -69.34 -51.69 34.48 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 121.808 0.813 . . . . 0.0 110.293 179.446 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.751 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -54.1 -59.25 4.9 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 114.209 -1.36 . . . . 0.0 111.039 -177.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.41 -36.17 53.55 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.37 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.6 ttt180 -65.29 -38.95 91.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.727 178.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -65.72 -41.69 91.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.645 178.965 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.577 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -61.99 -46.87 87.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.165 0.507 . . . . 0.0 109.662 178.773 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -69.34 -25.77 64.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.753 178.534 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' CB ' ' HG3' ' A' ' 33' ' ' LYS . . . -76.9 -22.65 53.08 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.414 179.875 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.91 23.9 5.41 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.481 -179.303 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.577 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.2 m-85 -131.81 148.73 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.325 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.465 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 21.3 t0 -92.54 75.41 5.11 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.936 179.965 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.688 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -86.55 141.4 29.07 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-O 121.228 0.537 . . . . 0.0 111.931 179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 1.6 pt -133.68 151.02 32.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.984 179.122 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.637 HG22 ' HB1' ' A' ' 59' ' ' ALA . 92.2 t -101.33 137.88 27.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.938 0.399 . . . . 0.0 111.03 -179.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 pt -138.71 136.89 43.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.179 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.458 HD13 ' CE1' ' A' ' 10' ' ' TYR . 14.8 tp -102.97 106.69 17.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.41 179.842 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -104.43 131.02 52.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.94 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.854 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.83 0.347 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -135.42 -46.88 0.69 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.967 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.2 86.64 3.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.921 -179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 t -134.04 111.37 10.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.911 179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -120.98 143.92 48.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.918 -179.867 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.88 -26.68 12.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.962 179.965 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t 66.51 47.13 1.73 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.912 179.932 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -98.8 -163.75 30.15 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.305 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt -144.21 139.62 28.81 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.878 0.371 . . . . 0.0 110.348 179.834 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.836 ' CE1' HD13 ' A' ' 77' ' ' LEU . 42.7 m-85 -101.69 106.25 17.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.838 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.451 ' HG2' ' HB1' ' A' ' 52' ' ' ALA . 19.1 mttt -125.11 152.32 44.55 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.473 179.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.041 HG21 ' HB3' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -105.17 139.87 24.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.306 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.197 179.712 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -132.61 134.56 45.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.792 0.33 . . . . 0.0 111.282 -179.135 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.578 HG22 ' CA ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -107.77 -5.74 10.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.234 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 160.13 172.62 27.6 Favored Glycine 0 C--N 1.337 0.588 0 C-N-CA 119.18 -1.486 . . . . 0.0 114.707 178.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.773 ' HB2' ' HG3' ' A' ' 47' ' ' LYS . . . -151.54 147.95 27.42 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.545 ' HE1' HD22 ' A' ' 26' ' ' LEU . 3.3 m-85 -152.21 153.11 33.16 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.485 -179.293 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.412 ' CG ' HD22 ' A' ' 45' ' ' LEU . 3.6 mtpp -59.8 -17.29 34.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.295 179.516 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.04 130.63 57.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.046 0.45 . . . . 0.0 111.915 -179.394 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 46' ' ' TYR . 0.3 OUTLIER -72.92 -38.21 66.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.231 179.515 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.18 66.24 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.7 m-20 -75.46 -33.61 60.86 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.099 178.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.567 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -72.33 -20.81 61.42 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.649 179.054 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.4 -37.48 25.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.47 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.5 t -66.19 -37.23 85.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.772 179.085 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.935 HD12 ' OD1' ' A' ' 29' ' ' ASN . 23.5 tp -68.19 -47.06 68.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.259 179.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.674 ' HB1' ' OG ' ' A' ' 37' ' ' SER . . . -59.87 -26.07 65.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.055 0.455 . . . . 0.0 110.349 178.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.54 61.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.091 179.87 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.935 ' OD1' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -59.64 -48.34 82.05 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 120.863 0.363 . . . . 0.0 110.616 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.962 ' CB ' HG21 ' A' ' 50' ' ' ILE . . . -62.58 -38.33 89.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.243 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -54.74 -36.61 64.97 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.387 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.67 -51.22 61.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.472 179.483 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -62.45 -28.2 69.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.73 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 108.44 33.24 2.97 Favored Glycine 0 N--CA 1.444 -0.775 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.44 179.025 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.732 ' CG ' HD11 ' A' ' 62' ' ' LEU . 5.9 m-85 -100.47 156.93 17.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 120.917 0.389 . . . . 0.0 110.628 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.96 95.21 8.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.935 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.674 ' OG ' ' HB1' ' A' ' 27' ' ' ALA . 51.5 p -80.14 155.01 27.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.174 0.512 . . . . 0.0 110.88 -178.801 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG23 ' HB3' ' A' ' 49' ' ' GLN . 0.6 OUTLIER -155.55 139.34 8.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.764 -178.47 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.61 ' HA ' ' O ' ' A' ' 47' ' ' LYS . 21.3 t -117.13 116.04 50.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.505 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.915 HD12 ' N ' ' A' ' 41' ' ' LEU . 0.4 OUTLIER -117.26 128.17 54.81 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.875 0.369 . . . . 0.0 110.436 179.815 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.915 ' N ' HD12 ' A' ' 40' ' ' LEU . 7.3 tp -90.75 116.76 28.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.891 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.657 ' HE3' ' H ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -109.64 145.96 35.58 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.554 ' HB2' ' HD2' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 36.79 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 O-C-N 123.169 0.293 . . . . 0.0 110.562 -178.953 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.657 ' H ' ' HE3' ' A' ' 42' ' ' LYS . . . -140.12 8.9 2.99 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.419 178.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.597 ' O ' HD12 ' A' ' 41' ' ' LEU . 13.4 mt -114.13 159.37 20.14 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 111.399 179.833 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.86 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 27.8 m-85 -115.56 135.84 53.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.848 178.797 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.773 ' HG3' ' HB2' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -108.22 148.97 29.19 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 111.266 -179.749 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.745 ' HB ' HD23 ' A' ' 26' ' ' LEU . 58.9 t -121.62 99.41 7.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.579 179.666 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.619 ' HB3' HG23 ' A' ' 38' ' ' ILE . 2.4 tt0 -104.02 142.25 34.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.907 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.962 HG21 ' CB ' ' A' ' 30' ' ' ALA . 1.7 pp -135.39 123.25 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.623 0.725 . . . . 0.0 111.281 179.423 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.537 ' O ' HG23 ' A' ' 12' ' ' VAL . . . 79.13 101.62 0.23 Allowed Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 114.768 -1.106 . . . . 0.0 112.888 179.726 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.569 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -124.99 116.42 22.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.664 0.269 . . . . 0.0 110.399 179.493 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -133.29 171.09 14.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.084 0.469 . . . . 0.0 111.637 -179.209 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.4 p -80.43 -17.86 50.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.956 179.556 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.2 m -113.41 131.75 55.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.947 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 10' ' ' TYR . 14.7 ttpt -57.64 -39.35 76.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.488 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -45.88 -32.1 2.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.02 0.438 . . . . 0.0 110.927 -179.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.459 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 73.2 m-80 -72.15 -49.41 36.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.308 179.705 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.628 ' HB1' HG22 ' A' ' 75' ' ' VAL . . . -57.49 -43.86 84.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.066 179.645 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.11 -49.81 76.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.872 0.368 . . . . 0.0 110.933 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.46 ' O ' ' HB2' ' A' ' 65' ' ' ARG . 7.8 m -59.46 -36.06 75.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.041 ' HB3' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -70.0 -52.74 21.71 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 121.792 0.806 . . . . 0.0 110.282 179.479 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.742 ' HB2' ' CG1' ' A' ' 12' ' ' VAL . . . -53.98 -58.22 8.12 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.982 -177.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.89 -37.0 60.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.348 179.361 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 61' ' ' THR . 1.7 ttt180 -64.74 -39.79 94.23 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.715 179.016 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . . . -64.69 -40.93 96.23 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.572 179.009 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 71' ' ' PHE . 0.3 OUTLIER -62.13 -46.99 86.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.562 178.834 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -69.44 -25.57 64.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.791 178.618 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HB1' ' CE2' ' A' ' 71' ' ' PHE . . . -76.82 -22.6 53.37 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.459 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.57 23.49 5.66 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 -179.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.555 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 1.0 OUTLIER -130.66 148.4 52.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.386 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.457 ' O ' ' HA ' ' A' ' 14' ' ' ILE . 25.6 t70 -91.98 74.65 5.59 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.69 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . . . -85.79 140.39 30.5 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.085 0.469 . . . . 0.0 111.88 179.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.429 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 2.4 pt -132.66 151.97 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.925 179.098 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.628 HG22 ' HB1' ' A' ' 59' ' ' ALA . 93.3 t -102.61 137.14 31.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.893 0.378 . . . . 0.0 111.114 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 11.0 tt -137.11 135.0 47.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.962 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.836 HD13 ' CE1' ' A' ' 10' ' ' TYR . 13.5 tp -95.57 106.09 18.14 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.071 179.841 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -90.79 103.39 16.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.985 -179.751 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.878 179.91 . . . . . . . . 0 0 . 1 stop_ save_