data_1r4k_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 1r4k _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 62.5 m . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.254 0.55 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 298' ' ' ALA . . . . . . . . . . . . . . . -126.47 140.17 52.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 110.73 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 299' ' ' PHE . . . . . 0.484 ' N ' ' CD1' ' A' ' 299' ' ' PHE . 27.3 p90 -150.83 116.48 5.47 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.417 -0.802 . . . . 0.0 110.045 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 300' ' ' TYR . . . . . 0.439 ' HB3' ' CB ' ' A' ' 425' ' ' GLN . 0.4 OUTLIER -115.18 45.08 1.7 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 110.82 -179.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' LYS . . . . . 0.441 ' CD ' ' HA3' ' A' ' 424' ' ' GLY . 0.0 OUTLIER -154.23 167.12 30.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.598 -0.689 . . . . 0.0 109.781 176.606 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -171.81 -84.2 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.025 -1.047 . . . . 0.0 110.602 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 303' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.37 87.57 0.12 Allowed Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.059 -1.026 . . . . 0.0 110.532 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 304' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -53.15 144.65 46.53 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 O-C-N 123.59 1.31 . . . . 0.0 110.772 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 305' ' ' VAL . . . . . 0.408 ' CG2' ' O ' ' A' ' 419' ' ' CYS . 17.7 t -51.65 -28.08 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.274 -0.891 . . . . 0.0 109.83 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 306' ' ' ILE . . . . . 0.433 ' CG2' HG12 ' A' ' 318' ' ' ILE . 37.5 mm -59.28 -46.23 92.51 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.0 110.012 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -72.25 -45.43 60.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.354 -0.841 . . . . 0.0 110.236 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 308' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -52.3 -50.5 62.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.186 -0.946 . . . . 0.0 110.387 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 309' ' ' MET . . . . . 0.429 ' HE3' ' CD1' ' A' ' 318' ' ' ILE . 39.3 ttp -58.49 -54.38 47.67 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.226 -0.922 . . . . 0.0 110.095 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 310' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.15 -23.06 12.87 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -0.902 . . . . 0.0 110.042 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 311' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -28.73 18.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.4 -0.813 . . . . 0.0 110.509 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 312' ' ' VAL . . . . . 0.407 ' CG1' ' CD ' ' A' ' 332' ' ' LYS . 87.9 t -85.87 -42.51 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.241 -0.912 . . . . 0.0 110.669 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 313' ' ' LEU . . . . . . . . . . . . . 83.9 mt -96.61 11.59 34.75 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.275 -0.891 . . . . 0.0 110.953 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 2.9 t0 50.79 93.72 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.001 -1.062 . . . . 0.0 110.427 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 315' ' ' ILE . . . . . . . . . . . . . 86.6 mt -133.52 146.77 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.935 . . . . 0.0 110.674 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 316' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.96 -37.93 54.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.31 -0.869 . . . . 0.0 110.288 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 317' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.22 120.85 3.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 110.263 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 318' ' ' ILE . . . . . 0.433 HG12 ' CG2' ' A' ' 306' ' ' ILE . 6.9 tp -52.38 -22.75 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.295 -0.878 . . . . 0.0 110.498 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 319' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -84.91 -16.73 40.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.18 -0.95 . . . . 0.0 110.572 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 320' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -86.26 -16.34 37.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.113 -0.992 . . . . 0.0 110.699 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 321' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -50.68 -69.83 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 53.59 21.48 2.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.212 -0.93 . . . . 0.0 110.843 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 323' ' ' LYS . . . . . . . . . . . . . 3.0 mmmm -137.95 148.36 60.16 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 110.486 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 324' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -70.62 140.5 39.57 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 O-C-N 123.535 1.281 . . . . 0.0 110.381 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 325' ' ' LEU . . . . . . . . . . . . . 74.3 mt -70.23 140.99 52.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.217 -0.927 . . . . 0.0 110.14 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 326' ' ' THR . . . . . . . . . . . . . 1.8 p -89.83 176.27 6.9 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.166 -0.959 . . . . 0.0 110.475 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 327' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -52.76 -53.86 42.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 110.492 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 328' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.86 -53.3 50.87 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.248 -0.908 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -47.53 83.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 110.41 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 24.2 ttm180 -55.76 -52.97 62.11 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 110.441 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 331' ' ' VAL . . . . . . . . . . . . . 43.0 t -58.47 -33.34 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.388 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 332' ' ' LYS . . . . . 0.407 ' CD ' ' CG1' ' A' ' 312' ' ' VAL . 0.6 OUTLIER -59.59 -65.64 0.64 Allowed 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.27 -0.894 . . . . 0.0 110.413 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 333' ' ' PHE . . . . . 0.469 ' CE1' HG22 ' A' ' 337' ' ' ILE . 36.2 t80 -54.75 -44.77 73.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.261 -0.899 . . . . 0.0 110.537 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 334' ' ' THR . . . . . . . . . . . . . 82.5 m -55.06 -43.1 73.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.231 -0.918 . . . . 0.0 110.519 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 335' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -39.54 93.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.0 110.457 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.23 -51.81 66.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.266 -0.896 . . . . 0.0 110.523 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 337' ' ' ILE . . . . . 0.469 HG22 ' CE1' ' A' ' 333' ' ' PHE . 23.0 pt -69.11 -133.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.247 -0.908 . . . . 0.0 110.281 -179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 338' ' ' LYS . . . . . 0.423 ' N ' HG13 ' A' ' 337' ' ' ILE . 3.3 tptt 62.99 94.02 0.05 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.648 -1.283 . . . . 0.0 110.26 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 339' ' ' GLY . . . . . . . . . . . . . . . 107.04 -36.3 4.49 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 340' ' ' LEU . . . . . . . . . . . . . 8.9 mp -53.96 155.01 3.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.28 -1.129 . . . . 0.0 110.369 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 341' ' ' LYS . . . . . 0.407 ' O ' ' HB ' ' A' ' 422' ' ' VAL . 1.6 tpmt? -99.57 112.75 24.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.195 -0.941 . . . . 0.0 109.844 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 342' ' ' ILE . . . . . 0.478 ' CG2' ' CG2' ' A' ' 356' ' ' VAL . 1.3 pp -108.0 141.14 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.885 -1.134 . . . . 0.0 111.087 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 343' ' ' GLU . . . . . 0.415 ' HA ' ' HA ' ' A' ' 353' ' ' LYS . 9.2 pt-20 -111.41 153.08 26.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.351 -0.843 . . . . 0.0 110.03 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 344' ' ' ILE . . . . . 0.434 ' CD1' ' HB2' ' A' ' 352' ' ' ARG . 21.3 pt -89.83 123.28 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.992 -1.067 . . . . 0.0 110.713 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 345' ' ' THR . . . . . . . . . . . . . 77.7 p -141.46 101.34 3.97 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 346' ' ' HIS . . . . . 0.485 ' CD2' ' N ' ' A' ' 347' ' ' CYS . 35.8 p-80 -150.44 -40.17 0.13 Allowed 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.353 -0.842 . . . . 0.0 110.672 -177.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 347' ' ' CYS . . . . . 0.485 ' N ' ' CD2' ' A' ' 346' ' ' HIS . 8.6 t -83.18 -27.28 30.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.184 -0.947 . . . . 0.0 110.194 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 348' ' ' GLY . . . . . . . . . . . . . . . 72.45 37.36 58.62 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 349' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -146.93 -43.91 0.18 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -1.178 . . . . 0.0 110.478 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 350' ' ' MET . . . . . . . . . . . . . 12.8 mmt -102.29 -61.32 1.41 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.578 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 351' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.41 148.8 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.401 -0.812 . . . . 0.0 110.488 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 352' ' ' ARG . . . . . 0.434 ' HB2' ' CD1' ' A' ' 344' ' ' ILE . 0.0 OUTLIER -159.13 -168.47 2.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.131 -0.981 . . . . 0.0 110.407 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 353' ' ' LYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 343' ' ' GLU . 0.1 OUTLIER -138.39 138.35 38.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.118 -0.989 . . . . 0.0 111.27 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 354' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -150.51 168.27 24.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.524 -0.735 . . . . 0.0 109.9 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 355' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 -103.59 158.75 16.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.918 -1.113 . . . . 0.0 110.151 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 356' ' ' VAL . . . . . 0.478 ' CG2' ' CG2' ' A' ' 342' ' ' ILE . 60.5 t -77.48 160.77 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 110.338 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 357' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -144.61 -38.72 0.28 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.246 -0.909 . . . . 0.0 110.706 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.62 -172.75 0.68 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.947 -1.096 . . . . 0.0 110.807 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 359' ' ' VAL . . . . . . . . . . . . . 88.4 t -131.23 136.45 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.304 -0.872 . . . . 0.0 109.688 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.431 ' OG1' ' CB ' ' A' ' 402' ' ' CYS . 47.0 p -89.6 145.6 25.14 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.196 -0.94 . . . . 0.0 110.108 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 361' ' ' ARG . . . . . . . . . . . . . 18.7 mtm-85 -88.23 -32.36 18.59 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.417 -0.802 . . . . 0.0 109.651 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 362' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 152.43 24.57 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.242 -0.911 . . . . 0.0 109.193 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 363' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -78.38 151.13 25.85 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.58 1.305 . . . . 0.0 110.064 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 384' ' ' ALA . . . -53.97 -44.48 70.82 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.027 -1.045 . . . . 0.0 110.193 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 365' ' ' GLN . . . . . 0.443 ' HA ' ' HB2' ' A' ' 384' ' ' ALA . 3.7 pt20 -43.66 -26.33 0.23 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.585 -0.697 . . . . 0.0 111.139 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 366' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -128.81 52.67 1.92 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.413 -0.805 . . . . 0.0 110.05 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 367' ' ' GLN . . . . . 0.473 ' CB ' ' HB ' ' A' ' 383' ' ' VAL . 4.8 mm-40 -102.76 81.08 1.97 Allowed 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 118.427 -1.309 . . . . 0.0 111.469 -177.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 382' ' ' THR . 12.6 p -64.67 125.86 26.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.276 -0.89 . . . . 0.0 110.646 179.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' PHE . . . . . 0.465 ' CD1' HG22 ' A' ' 383' ' ' VAL . 14.8 p90 -135.37 174.87 4.08 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.215 -0.928 . . . . 0.0 110.484 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' PRO . . . . . 0.411 ' CD ' ' HB2' ' A' ' 369' ' ' PHE . 27.9 Cg_endo -89.84 97.64 0.3 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.881 1.464 . . . . 0.0 111.152 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 51.3 tp -89.84 116.28 27.8 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.197 -0.94 . . . . 0.0 109.159 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.06 133.73 33.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.943 -1.098 . . . . 0.0 110.251 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' LEU . . . . . 0.472 ' CD2' ' N ' ' A' ' 373' ' ' LEU . 4.5 mm? -105.34 122.58 46.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.515 -0.741 . . . . 0.0 110.596 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.47 -15.43 26.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.447 -0.783 . . . . 0.0 110.988 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -52.38 -23.03 5.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.0 110.384 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' GLY . . . . . . . . . . . . . . . 124.06 36.77 0.6 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.27 151.26 0.99 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.212 -1.17 . . . . 0.0 110.16 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' THR . . . . . . . . . . . . . 35.8 m -95.24 149.32 21.46 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.073 -1.017 . . . . 0.0 110.173 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' VAL . . . . . 0.446 ' HB ' ' CD2' ' A' ' 373' ' ' LEU . 48.9 t -126.5 169.65 17.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.566 -0.709 . . . . 0.0 110.555 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . 0.424 ' N ' ' CG1' ' A' ' 379' ' ' VAL . 17.7 tt0 -123.34 103.67 8.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.42 -0.8 . . . . 0.0 109.459 178.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -108.72 -171.78 1.92 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.195 -0.941 . . . . 0.0 110.377 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 368' ' ' SER . 0.2 OUTLIER -126.87 141.23 51.87 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.187 -0.946 . . . . 0.0 110.522 -179.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' VAL . . . . . 0.473 ' HB ' ' CB ' ' A' ' 367' ' ' GLN . 90.8 t -88.89 152.83 3.29 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.301 -0.875 . . . . 0.0 109.332 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' ALA . . . . . 0.443 ' HB2' ' HA ' ' A' ' 365' ' ' GLN . . . 73.92 25.55 1.89 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-O 121.711 0.767 . . . . 0.0 109.323 -176.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.98 -44.16 0.07 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -68.97 -48.33 63.41 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.538 -0.726 . . . . 0.0 109.201 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 392' ' ' ARG . 89.3 m-85 -53.24 -32.94 50.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.496 -0.752 . . . . 0.0 110.1 178.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.01 -25.69 66.42 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.476 -0.765 . . . . 0.0 110.642 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.14 -49.66 6.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.2 -0.938 . . . . 0.0 110.967 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -50.55 6.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.151 -0.968 . . . . 0.0 111.011 -178.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -88.41 -0.34 57.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.136 -0.977 . . . . 0.0 111.125 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 387' ' ' PHE . 16.8 mtt-85 51.76 23.19 1.92 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.955 -1.091 . . . . 0.0 110.55 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 6.2 mmm -84.45 118.69 24.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 109.993 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 396' ' ' ARG . 0.0 OUTLIER -84.48 9.1 14.3 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.061 -1.024 . . . . 0.0 111.134 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' LEU . . . . . 0.414 ' O ' ' CB ' ' A' ' 396' ' ' ARG . 0.2 OUTLIER 62.41 -65.97 0.08 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.456 -0.777 . . . . 0.0 112.466 177.47 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' ARG . . . . . 0.461 ' N ' ' O ' ' A' ' 394' ' ' LYS . 0.0 OUTLIER 68.8 7.48 6.18 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.029 -1.044 . . . . 0.0 110.593 -177.467 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' TYR . . . . . 0.545 ' N ' ' CD ' ' A' ' 398' ' ' PRO . 75.4 m-85 -144.77 45.74 0.54 Allowed Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 120.964 -1.085 . . . . 0.0 111.194 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 397' ' ' TYR . 37.0 Cg_endo -74.91 -55.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.282 1.148 . . . . 0.0 111.773 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' HIS . . . . . 0.444 ' CD2' HD13 ' A' ' 400' ' ' LEU . 35.5 p-80 -43.67 -35.22 1.71 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.472 -0.768 . . . . 0.0 111.908 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 399' ' ' HIS . 0.3 OUTLIER -71.0 177.34 1.54 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 120.941 -1.099 . . . . 0.0 110.325 179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' PRO . . . . . 0.432 ' CD ' ' HG ' ' A' ' 400' ' ' LEU . 30.6 Cg_endo -80.45 -162.67 0.19 Allowed 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.643 1.338 . . . . 0.0 110.574 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' CYS . . . . . 0.431 ' CB ' ' OG1' ' A' ' 360' ' ' THR . 0.1 OUTLIER -136.97 167.71 20.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.434 179.488 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.6 150.66 22.86 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 110.624 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.63 122.93 43.74 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.356 -0.84 . . . . 0.0 110.283 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.422 HG12 ' CD1' ' A' ' 342' ' ' ILE . 16.1 m -138.05 135.09 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.197 -0.939 . . . . 0.0 110.876 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' GLY . . . . . . . . . . . . . . . -150.28 124.45 1.75 Allowed Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.116 -1.594 . . . . 0.0 109.116 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -53.05 -68.25 0.19 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.201 -1.176 . . . . 0.0 110.497 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 -40.56 1.96 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -148.98 35.61 0.76 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.463 -0.773 . . . . 0.0 109.7 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -93.58 -176.65 4.15 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.458 -0.776 . . . . 0.0 110.785 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.75 57.7 0.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.451 -0.781 . . . . 0.0 109.775 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' THR . . . . . 0.402 HG21 HD22 ' A' ' 414' ' ' LEU . 7.0 m -85.72 114.37 22.63 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 110.745 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -97.75 108.97 21.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.326 -0.859 . . . . 0.0 109.965 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' LEU . . . . . 0.483 ' N ' ' CD2' ' A' ' 414' ' ' LEU . 3.3 mm? -104.82 159.55 28.97 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.13 -0.981 . . . . 0.0 110.162 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -88.58 -160.27 0.1 OUTLIER 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.613 1.323 . . . . 0.0 110.041 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' LEU . . . . . 0.465 ' CD2' ' N ' ' A' ' 416' ' ' LEU . 4.1 mm? -61.66 -67.63 0.39 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.074 -1.016 . . . . 0.0 109.197 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' GLU . . . . . 0.437 ' O ' ' N ' ' A' ' 419' ' ' CYS . 3.1 tt0 -59.43 -165.38 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.157 -0.964 . . . . 0.0 108.676 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' VAL . . . . . 0.476 ' CG2' ' HB3' ' A' ' 346' ' ' HIS . 2.4 t 66.04 -69.41 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 120.879 -1.138 . . . . 0.0 109.593 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' CYS . . . . . 0.437 ' N ' ' O ' ' A' ' 417' ' ' GLU . 48.0 t -71.56 91.2 1.05 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.677 -1.264 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 342' ' ' ILE . 0.8 OUTLIER -89.33 165.04 14.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -0.902 . . . . 0.0 109.284 178.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' ILE . . . . . . . . . . . . . 36.0 mm -100.0 151.14 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.165 -0.959 . . . . 0.0 111.178 -178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' VAL . . . . . 0.407 ' HB ' ' O ' ' A' ' 341' ' ' LYS . 2.4 t -148.56 126.96 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.328 -0.857 . . . . 0.0 109.442 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -177.61 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.357 -0.839 . . . . 0.0 109.855 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . 0.441 ' HA3' ' CD ' ' A' ' 301' ' ' LYS . . . -110.84 -113.92 3.47 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' GLN . . . . . 0.439 ' CB ' ' HB3' ' A' ' 300' ' ' TYR . 2.1 tt0 -102.21 72.87 1.32 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.104 -1.233 . . . . 0.0 109.929 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . 0.428 ' NE ' ' CB ' ' A' ' 299' ' ' PHE . 2.4 mmt180 -94.09 146.24 24.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.415 -0.803 . . . . 0.0 110.89 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -149.57 93.21 2.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.956 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' ILE . . . . . 0.458 HG21 HD13 ' A' ' 428' ' ' ILE . 42.6 pt -113.99 -166.74 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.158 -0.964 . . . . 0.0 110.732 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -105.2 111.79 24.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.3 -0.875 . . . . 0.0 110.341 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -94.22 22.01 6.37 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 110.411 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.29 -172.12 3.62 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.421 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 9.6 t -167.95 -160.35 0.33 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 110.406 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.0 142.34 50.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.274 -0.891 . . . . 0.0 110.364 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.66 62.01 1.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 110.352 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -118.23 118.28 31.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.23 -0.919 . . . . 0.0 110.457 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 87.7 m -97.71 137.13 37.06 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.297 -0.877 . . . . 0.0 110.291 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 1.2 m -111.08 -174.39 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.22 -0.925 . . . . 0.0 110.414 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 43.94 32.43 0.62 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.495 -0.753 . . . . 0.0 111.004 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.04 78.05 2.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' ILE . . . . . . . . . . . . . 10.8 tt -95.74 69.87 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.279 -0.888 . . . . 0.0 110.158 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.14 -172.0 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.469 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -102.85 154.2 19.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.224 -0.923 . . . . 0.0 110.283 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.59 157.08 37.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.93 . . . . 0.0 110.405 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' ALA . . . . . . . . . . . . . . . -83.89 62.77 7.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.248 -0.907 . . . . 0.0 110.329 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.6 176.33 10.49 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.247 -0.908 . . . . 0.0 110.359 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.73 -177.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.25 -0.906 . . . . 0.0 110.435 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -157.28 154.63 26.23 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.397 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.67 152.89 25.99 Favored 'Trans proline' 0 C--N 1.312 -1.364 0 O-C-N 123.613 1.323 . . . . 0.0 110.475 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.8 174.37 5.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 110.343 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' ARG . . . . . 0.427 ' NH1' ' HG2' ' A' ' 450' ' ' ARG . 0.0 OUTLIER -55.46 143.84 27.79 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.317 -0.864 . . . . 0.0 110.329 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -128.77 170.05 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.178 -0.952 . . . . 0.0 110.262 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 454' ' ' ILE . 0.1 OUTLIER -59.61 99.45 0.06 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 110.294 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.09 70.96 0.16 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.229 -0.919 . . . . 0.0 110.491 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.413 ' N ' ' O ' ' A' ' 452' ' ' ARG . 43.0 mt -57.88 133.37 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.0 110.25 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -93.59 155.08 17.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 110.44 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 53.22 176.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.365 -0.834 . . . . 0.0 110.449 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.8 mt 52.98 177.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.465 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' VAL . . . . . 0.405 ' O ' ' CG2' ' A' ' 458' ' ' VAL . 10.4 p -161.21 34.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 110.285 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm 55.2 171.68 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.301 -0.874 . . . . 0.0 110.481 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . . . . . . . . . 29.6 ttm-85 -131.11 118.49 20.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.206 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' ALA . . . . . . . . . . . . . . . -96.75 175.81 6.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 110.47 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.95 174.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 110.482 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -104.99 -60.29 1.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.237 -0.914 . . . . 0.0 110.263 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.333 -179.895 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 62.5 m . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.254 0.55 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 298' ' ' ALA . . . . . . . . . . . . . . . -126.47 140.17 52.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 110.73 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 299' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 299' ' ' PHE . 27.3 p90 -150.83 116.48 5.47 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.417 -0.802 . . . . 0.0 110.045 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 300' ' ' TYR . . . . . 0.464 ' HB3' ' CB ' ' A' ' 425' ' ' GLN . 0.4 OUTLIER -115.18 45.08 1.7 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 110.82 -179.324 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 301' ' ' LYS . . . . . 0.457 ' CD ' ' HA3' ' A' ' 424' ' ' GLY . 0.0 OUTLIER -154.23 167.12 30.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.598 -0.689 . . . . 0.0 109.781 176.606 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 302' ' ' ALA . . . . . 0.402 ' O ' ' HB ' ' A' ' 421' ' ' ILE . . . -171.81 -84.2 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.025 -1.047 . . . . 0.0 110.602 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 303' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.37 87.57 0.12 Allowed Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.059 -1.026 . . . . 0.0 110.532 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 304' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -53.15 144.65 46.53 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 O-C-N 123.59 1.31 . . . . 0.0 110.772 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 305' ' ' VAL . . . . . 0.459 HG13 ' CZ ' ' A' ' 333' ' ' PHE . 17.7 t -51.65 -28.08 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.274 -0.891 . . . . 0.0 109.83 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 306' ' ' ILE . . . . . 0.976 HG23 HG12 ' A' ' 318' ' ' ILE . 37.5 mm -59.28 -46.23 92.51 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.0 110.012 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -72.25 -45.43 60.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.354 -0.841 . . . . 0.0 110.236 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 308' ' ' PHE . . . . . 0.592 ' O ' HG23 ' A' ' 312' ' ' VAL . 3.0 t80 -52.3 -50.5 62.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.186 -0.946 . . . . 0.0 110.387 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 309' ' ' MET . . . . . 0.453 ' HE2' HD13 ' A' ' 318' ' ' ILE . 39.3 ttp -58.49 -54.38 47.67 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.226 -0.922 . . . . 0.0 110.095 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 310' ' ' CYS . . . . . 0.426 ' HA ' HD12 ' A' ' 315' ' ' ILE . 42.0 t -54.15 -23.06 12.87 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -0.902 . . . . 0.0 110.042 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 311' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -28.73 18.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.4 -0.813 . . . . 0.0 110.509 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 312' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 308' ' ' PHE . 87.9 t -85.87 -42.51 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.241 -0.912 . . . . 0.0 110.669 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 313' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 313' ' ' LEU . 83.9 mt -96.61 11.59 34.75 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.275 -0.891 . . . . 0.0 110.953 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 2.9 t0 50.79 93.72 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.001 -1.062 . . . . 0.0 110.427 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 315' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' A' ' 310' ' ' CYS . 86.6 mt -133.52 146.77 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.935 . . . . 0.0 110.674 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 316' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.96 -37.93 54.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.31 -0.869 . . . . 0.0 110.288 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 317' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.22 120.85 3.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 110.263 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 318' ' ' ILE . . . . . 0.976 HG12 HG23 ' A' ' 306' ' ' ILE . 6.9 tp -52.38 -22.75 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.295 -0.878 . . . . 0.0 110.498 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 319' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -84.91 -16.73 40.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.18 -0.95 . . . . 0.0 110.572 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 320' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -86.26 -16.34 37.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.113 -0.992 . . . . 0.0 110.699 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 321' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -50.68 -69.83 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 322' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 53.59 21.48 2.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.212 -0.93 . . . . 0.0 110.843 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 323' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 324' ' ' PRO . 3.0 mmmm -137.95 148.36 60.16 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 110.486 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 324' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 323' ' ' LYS . 3.0 Cg_exo -70.62 140.5 39.57 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 O-C-N 123.535 1.281 . . . . 0.0 110.381 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 325' ' ' LEU . . . . . 0.568 HD12 ' CG ' ' A' ' 401' ' ' PRO . 74.3 mt -70.23 140.99 52.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.217 -0.927 . . . . 0.0 110.14 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 326' ' ' THR . . . . . . . . . . . . . 1.8 p -89.83 176.27 6.9 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.166 -0.959 . . . . 0.0 110.475 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 327' ' ' ASP . . . . . 0.694 ' O ' HG23 ' A' ' 331' ' ' VAL . 8.1 m-20 -52.76 -53.86 42.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 110.492 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 328' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.86 -53.3 50.87 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.248 -0.908 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -47.53 83.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 110.41 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 24.2 ttm180 -55.76 -52.97 62.11 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 110.441 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 331' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 327' ' ' ASP . 43.0 t -58.47 -33.34 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.388 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 332' ' ' LYS . . . . . 0.476 ' HD2' HG12 ' A' ' 312' ' ' VAL . 0.6 OUTLIER -59.59 -65.64 0.64 Allowed 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.27 -0.894 . . . . 0.0 110.413 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 333' ' ' PHE . . . . . 0.459 ' CZ ' HG13 ' A' ' 305' ' ' VAL . 36.2 t80 -54.75 -44.77 73.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.261 -0.899 . . . . 0.0 110.537 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 334' ' ' THR . . . . . . . . . . . . . 82.5 m -55.06 -43.1 73.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.231 -0.918 . . . . 0.0 110.519 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 335' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -39.54 93.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.0 110.457 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.23 -51.81 66.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.266 -0.896 . . . . 0.0 110.523 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 337' ' ' ILE . . . . . 0.49 ' HB ' HG11 ' A' ' 356' ' ' VAL . 23.0 pt -69.11 -133.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.247 -0.908 . . . . 0.0 110.281 -179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 338' ' ' LYS . . . . . 0.515 ' H ' HG11 ' A' ' 356' ' ' VAL . 3.3 tptt 62.99 94.02 0.05 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.648 -1.283 . . . . 0.0 110.26 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 339' ' ' GLY . . . . . . . . . . . . . . . 107.04 -36.3 4.49 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 340' ' ' LEU . . . . . . . . . . . . . 8.9 mp -53.96 155.01 3.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.28 -1.129 . . . . 0.0 110.369 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 341' ' ' LYS . . . . . 0.439 ' O ' ' HB ' ' A' ' 422' ' ' VAL . 1.6 tpmt? -99.57 112.75 24.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.195 -0.941 . . . . 0.0 109.844 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 342' ' ' ILE . . . . . 0.986 HD11 HG11 ' A' ' 405' ' ' VAL . 1.3 pp -108.0 141.14 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.885 -1.134 . . . . 0.0 111.087 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 343' ' ' GLU . . . . . 0.445 ' HA ' ' HA ' ' A' ' 353' ' ' LYS . 9.2 pt-20 -111.41 153.08 26.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.351 -0.843 . . . . 0.0 110.03 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 344' ' ' ILE . . . . . 0.817 HD11 ' HB2' ' A' ' 352' ' ' ARG . 21.3 pt -89.83 123.28 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.992 -1.067 . . . . 0.0 110.713 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 345' ' ' THR . . . . . 0.511 HG22 ' CG ' ' A' ' 351' ' ' ARG . 77.7 p -141.46 101.34 3.97 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 346' ' ' HIS . . . . . 0.837 ' HB3' HG22 ' A' ' 418' ' ' VAL . 35.8 p-80 -150.44 -40.17 0.13 Allowed 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.353 -0.842 . . . . 0.0 110.672 -177.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 347' ' ' CYS . . . . . 0.485 ' N ' ' CD2' ' A' ' 346' ' ' HIS . 8.6 t -83.18 -27.28 30.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.184 -0.947 . . . . 0.0 110.194 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 348' ' ' GLY . . . . . . . . . . . . . . . 72.45 37.36 58.62 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 349' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -146.93 -43.91 0.18 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -1.178 . . . . 0.0 110.478 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 350' ' ' MET . . . . . . . . . . . . . 12.8 mmt -102.29 -61.32 1.41 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.578 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 351' ' ' ARG . . . . . 0.511 ' CG ' HG22 ' A' ' 345' ' ' THR . 0.0 OUTLIER 60.41 148.8 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.401 -0.812 . . . . 0.0 110.488 -179.58 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 352' ' ' ARG . . . . . 0.817 ' HB2' HD11 ' A' ' 344' ' ' ILE . 0.0 OUTLIER -159.13 -168.47 2.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.131 -0.981 . . . . 0.0 110.407 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 353' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 343' ' ' GLU . 0.1 OUTLIER -138.39 138.35 38.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.118 -0.989 . . . . 0.0 111.27 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 354' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -150.51 168.27 24.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.524 -0.735 . . . . 0.0 109.9 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 355' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 -103.59 158.75 16.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.918 -1.113 . . . . 0.0 110.151 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 356' ' ' VAL . . . . . 0.735 ' HA ' HG12 ' A' ' 405' ' ' VAL . 60.5 t -77.48 160.77 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 110.338 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 357' ' ' CYS . . . . . 0.401 ' N ' HG12 ' A' ' 356' ' ' VAL . 0.8 OUTLIER -144.61 -38.72 0.28 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.246 -0.909 . . . . 0.0 110.706 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 358' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -174.62 -172.75 0.68 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.947 -1.096 . . . . 0.0 110.807 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 359' ' ' VAL . . . . . . . . . . . . . 88.4 t -131.23 136.45 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.304 -0.872 . . . . 0.0 109.688 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.57 HG21 ' HD2' ' A' ' 413' ' ' TYR . 47.0 p -89.6 145.6 25.14 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.196 -0.94 . . . . 0.0 110.108 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 361' ' ' ARG . . . . . . . . . . . . . 18.7 mtm-85 -88.23 -32.36 18.59 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.417 -0.802 . . . . 0.0 109.651 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 362' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 152.43 24.57 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.242 -0.911 . . . . 0.0 109.193 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 363' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -78.38 151.13 25.85 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.58 1.305 . . . . 0.0 110.064 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 364' ' ' ALA . . . . . 0.752 ' HB3' ' HA ' ' A' ' 398' ' ' PRO . . . -53.97 -44.48 70.82 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.027 -1.045 . . . . 0.0 110.193 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 365' ' ' GLN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 398' ' ' PRO . 3.7 pt20 -43.66 -26.33 0.23 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.585 -0.697 . . . . 0.0 111.139 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 366' ' ' MET . . . . . 0.423 ' HG3' ' HG3' ' A' ' 365' ' ' GLN . 1.0 OUTLIER -128.81 52.67 1.92 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.413 -0.805 . . . . 0.0 110.05 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 367' ' ' GLN . . . . . 0.487 ' CB ' ' HB ' ' A' ' 383' ' ' VAL . 4.8 mm-40 -102.76 81.08 1.97 Allowed 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 118.427 -1.309 . . . . 0.0 111.469 -177.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 368' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 382' ' ' THR . 12.6 p -64.67 125.86 26.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.276 -0.89 . . . . 0.0 110.646 179.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 369' ' ' PHE . . . . . 0.765 ' CD1' HG23 ' A' ' 383' ' ' VAL . 14.8 p90 -135.37 174.87 4.08 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.215 -0.928 . . . . 0.0 110.484 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 370' ' ' PRO . . . . . 0.414 ' HD2' ' HB2' ' A' ' 369' ' ' PHE . 27.9 Cg_endo -89.84 97.64 0.3 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.881 1.464 . . . . 0.0 111.152 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 51.3 tp -89.84 116.28 27.8 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.197 -0.94 . . . . 0.0 109.159 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 372' ' ' GLN . . . . . 0.552 ' C ' HD22 ' A' ' 373' ' ' LEU . 4.1 mp0 -88.06 133.73 33.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.943 -1.098 . . . . 0.0 110.251 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 373' ' ' LEU . . . . . 0.581 HD23 ' HB ' ' A' ' 379' ' ' VAL . 4.5 mm? -105.34 122.58 46.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.515 -0.741 . . . . 0.0 110.596 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.47 -15.43 26.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.447 -0.783 . . . . 0.0 110.988 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 375' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -52.38 -23.03 5.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.0 110.384 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' GLY . . . . . . . . . . . . . . . 124.06 36.77 0.6 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.27 151.26 0.99 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.212 -1.17 . . . . 0.0 110.16 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 378' ' ' THR . . . . . . . . . . . . . 35.8 m -95.24 149.32 21.46 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.073 -1.017 . . . . 0.0 110.173 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 379' ' ' VAL . . . . . 0.581 ' HB ' HD23 ' A' ' 373' ' ' LEU . 48.9 t -126.5 169.65 17.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.566 -0.709 . . . . 0.0 110.555 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.484 ' N ' HG12 ' A' ' 379' ' ' VAL . 17.7 tt0 -123.34 103.67 8.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.42 -0.8 . . . . 0.0 109.459 178.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 381' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -108.72 -171.78 1.92 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.195 -0.941 . . . . 0.0 110.377 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 382' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 368' ' ' SER . 0.2 OUTLIER -126.87 141.23 51.87 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.187 -0.946 . . . . 0.0 110.522 -179.324 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 383' ' ' VAL . . . . . 0.765 HG23 ' CD1' ' A' ' 369' ' ' PHE . 90.8 t -88.89 152.83 3.29 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.301 -0.875 . . . . 0.0 109.332 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 384' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' A' ' 383' ' ' VAL . . . 73.92 25.55 1.89 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-O 121.711 0.767 . . . . 0.0 109.323 -176.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 385' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.98 -44.16 0.07 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 386' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -68.97 -48.33 63.41 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.538 -0.726 . . . . 0.0 109.201 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 392' ' ' ARG . 89.3 m-85 -53.24 -32.94 50.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.496 -0.752 . . . . 0.0 110.1 178.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 388' ' ' LEU . . . . . 0.521 HD11 ' HE2' ' A' ' 394' ' ' LYS . 0.9 OUTLIER -67.01 -25.69 66.42 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.476 -0.765 . . . . 0.0 110.642 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 389' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.14 -49.66 6.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.2 -0.938 . . . . 0.0 110.967 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -50.55 6.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.151 -0.968 . . . . 0.0 111.011 -178.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 391' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -88.41 -0.34 57.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.136 -0.977 . . . . 0.0 111.125 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 392' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 387' ' ' PHE . 16.8 mtt-85 51.76 23.19 1.92 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.955 -1.091 . . . . 0.0 110.55 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 6.2 mmm -84.45 118.69 24.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 109.993 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 394' ' ' LYS . . . . . 0.521 ' HE2' HD11 ' A' ' 388' ' ' LEU . 0.0 OUTLIER -84.48 9.1 14.3 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.061 -1.024 . . . . 0.0 111.134 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 395' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 395' ' ' LEU . 0.2 OUTLIER 62.41 -65.97 0.08 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.456 -0.777 . . . . 0.0 112.466 177.47 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 396' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 394' ' ' LYS . 0.0 OUTLIER 68.8 7.48 6.18 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.029 -1.044 . . . . 0.0 110.593 -177.467 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 397' ' ' TYR . . . . . 0.545 ' N ' ' CD ' ' A' ' 398' ' ' PRO . 75.4 m-85 -144.77 45.74 0.54 Allowed Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 120.964 -1.085 . . . . 0.0 111.194 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.752 ' HA ' ' HB3' ' A' ' 364' ' ' ALA . 37.0 Cg_endo -74.91 -55.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.282 1.148 . . . . 0.0 111.773 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 399' ' ' HIS . . . . . 0.467 ' HD2' HD12 ' A' ' 400' ' ' LEU . 35.5 p-80 -43.67 -35.22 1.71 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.472 -0.768 . . . . 0.0 111.908 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 400' ' ' LEU . . . . . 0.467 HD12 ' HD2' ' A' ' 399' ' ' HIS . 0.3 OUTLIER -71.0 177.34 1.54 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 120.941 -1.099 . . . . 0.0 110.325 179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 401' ' ' PRO . . . . . 0.568 ' CG ' HD12 ' A' ' 325' ' ' LEU . 30.6 Cg_endo -80.45 -162.67 0.19 Allowed 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.643 1.338 . . . . 0.0 110.574 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 402' ' ' CYS . . . . . 0.431 ' CB ' ' OG1' ' A' ' 360' ' ' THR . 0.1 OUTLIER -136.97 167.71 20.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.434 179.488 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 403' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.6 150.66 22.86 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 110.624 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 404' ' ' GLN . . . . . 0.432 ' NE2' ' CE2' ' A' ' 413' ' ' TYR . 5.4 tp60 -118.63 122.93 43.74 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.356 -0.84 . . . . 0.0 110.283 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.986 HG11 HD11 ' A' ' 342' ' ' ILE . 16.1 m -138.05 135.09 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.197 -0.939 . . . . 0.0 110.876 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' GLY . . . . . . . . . . . . . . . -150.28 124.45 1.75 Allowed Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.116 -1.594 . . . . 0.0 109.116 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 407' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -53.05 -68.25 0.19 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.201 -1.176 . . . . 0.0 110.497 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 -40.56 1.96 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 409' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -148.98 35.61 0.76 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.463 -0.773 . . . . 0.0 109.7 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -93.58 -176.65 4.15 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.458 -0.776 . . . . 0.0 110.785 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.75 57.7 0.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.451 -0.781 . . . . 0.0 109.775 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 412' ' ' THR . . . . . 0.912 HG22 HD21 ' A' ' 414' ' ' LEU . 7.0 m -85.72 114.37 22.63 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 110.745 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 413' ' ' TYR . . . . . 0.57 ' HD2' HG21 ' A' ' 360' ' ' THR . 84.5 m-85 -97.75 108.97 21.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.326 -0.859 . . . . 0.0 109.965 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 414' ' ' LEU . . . . . 0.912 HD21 HG22 ' A' ' 412' ' ' THR . 3.3 mm? -104.82 159.55 28.97 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.13 -0.981 . . . . 0.0 110.162 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 415' ' ' PRO . . . . . 0.426 ' HB3' HD11 ' A' ' 395' ' ' LEU . 10.5 Cg_endo -88.58 -160.27 0.1 OUTLIER 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.613 1.323 . . . . 0.0 110.041 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 416' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 416' ' ' LEU . 4.1 mm? -61.66 -67.63 0.39 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.074 -1.016 . . . . 0.0 109.197 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 417' ' ' GLU . . . . . 0.501 ' C ' HG23 ' A' ' 418' ' ' VAL . 3.1 tt0 -59.43 -165.38 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.157 -0.964 . . . . 0.0 108.676 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 418' ' ' VAL . . . . . 0.837 HG22 ' HB3' ' A' ' 346' ' ' HIS . 2.4 t 66.04 -69.41 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 120.879 -1.138 . . . . 0.0 109.593 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 419' ' ' CYS . . . . . 0.873 ' SG ' HD13 ' A' ' 342' ' ' ILE . 48.0 t -71.56 91.2 1.05 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.677 -1.264 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 420' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 342' ' ' ILE . 0.8 OUTLIER -89.33 165.04 14.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -0.902 . . . . 0.0 109.284 178.388 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 421' ' ' ILE . . . . . 0.621 HD13 HG22 ' A' ' 342' ' ' ILE . 36.0 mm -100.0 151.14 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.165 -0.959 . . . . 0.0 111.178 -178.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 422' ' ' VAL . . . . . 0.527 HG12 ' HG3' ' A' ' 426' ' ' ARG . 2.4 t -148.56 126.96 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.328 -0.857 . . . . 0.0 109.442 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.422 ' HB2' ' O ' ' A' ' 422' ' ' VAL . . . -177.61 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.357 -0.839 . . . . 0.0 109.855 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 424' ' ' GLY . . . . . 0.457 ' HA3' ' CD ' ' A' ' 301' ' ' LYS . . . -110.84 -113.92 3.47 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 425' ' ' GLN . . . . . 0.464 ' CB ' ' HB3' ' A' ' 300' ' ' TYR . 2.1 tt0 -102.21 72.87 1.32 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.104 -1.233 . . . . 0.0 109.929 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 426' ' ' ARG . . . . . 0.527 ' HG3' HG12 ' A' ' 422' ' ' VAL . 2.4 mmt180 -94.09 146.24 24.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.415 -0.803 . . . . 0.0 110.89 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 427' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -149.57 93.21 2.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.956 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . 42.6 pt -113.99 -166.74 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.158 -0.964 . . . . 0.0 110.732 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 429' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -105.2 111.79 24.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.3 -0.875 . . . . 0.0 110.341 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -94.22 22.01 6.37 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 110.411 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 431' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.29 -172.12 3.62 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.421 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 9.6 t -167.95 -160.35 0.33 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 110.406 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.0 142.34 50.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.274 -0.891 . . . . 0.0 110.364 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 434' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.66 62.01 1.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 110.352 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -118.23 118.28 31.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.23 -0.919 . . . . 0.0 110.457 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 87.7 m -97.71 137.13 37.06 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.297 -0.877 . . . . 0.0 110.291 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 1.2 m -111.08 -174.39 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.22 -0.925 . . . . 0.0 110.414 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 43.94 32.43 0.62 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.495 -0.753 . . . . 0.0 111.004 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 439' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.04 78.05 2.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 440' ' ' ILE . . . . . 0.546 ' O ' HG23 ' A' ' 440' ' ' ILE . 10.8 tt -95.74 69.87 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.279 -0.888 . . . . 0.0 110.158 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 441' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.14 -172.0 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.469 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -102.85 154.2 19.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.224 -0.923 . . . . 0.0 110.283 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 443' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.59 157.08 37.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.93 . . . . 0.0 110.405 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 444' ' ' ALA . . . . . . . . . . . . . . . -83.89 62.77 7.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.248 -0.907 . . . . 0.0 110.329 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.6 176.33 10.49 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.247 -0.908 . . . . 0.0 110.359 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.73 -177.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.25 -0.906 . . . . 0.0 110.435 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -157.28 154.63 26.23 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.397 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.67 152.89 25.99 Favored 'Trans proline' 0 C--N 1.312 -1.364 0 O-C-N 123.613 1.323 . . . . 0.0 110.475 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 450' ' ' ARG . 17.6 t0 -107.8 174.37 5.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 110.343 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 450' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 449' ' ' ASP . 0.0 OUTLIER -55.46 143.84 27.79 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.317 -0.864 . . . . 0.0 110.329 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -128.77 170.05 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.178 -0.952 . . . . 0.0 110.262 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 454' ' ' ILE . 0.1 OUTLIER -59.61 99.45 0.06 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 110.294 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.09 70.96 0.16 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.229 -0.919 . . . . 0.0 110.491 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.413 ' N ' ' O ' ' A' ' 452' ' ' ARG . 43.0 mt -57.88 133.37 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.0 110.25 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 455' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -93.59 155.08 17.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 110.44 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 53.22 176.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.365 -0.834 . . . . 0.0 110.449 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.8 mt 52.98 177.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.465 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 458' ' ' VAL . 10.4 p -161.21 34.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 110.285 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm 55.2 171.68 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.301 -0.874 . . . . 0.0 110.481 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' ARG . . . . . . . . . . . . . 29.6 ttm-85 -131.11 118.49 20.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.206 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' ALA . . . . . . . . . . . . . . . -96.75 175.81 6.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 110.47 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.95 174.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 110.482 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -104.99 -60.29 1.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.237 -0.914 . . . . 0.0 110.263 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.333 -179.895 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 297' ' ' THR . . . . . . . . . . . . . 62.5 m . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.254 0.55 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 298' ' ' ALA . . . . . . . . . . . . . . . -126.47 140.17 52.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.21 -0.931 . . . . 0.0 110.73 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 299' ' ' PHE . . . . . 0.484 ' CD1' ' N ' ' A' ' 299' ' ' PHE . 27.3 p90 -150.83 116.48 5.47 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.417 -0.802 . . . . 0.0 110.045 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 300' ' ' TYR . . . . . 0.464 ' HB3' ' CB ' ' A' ' 425' ' ' GLN . 0.4 OUTLIER -115.18 45.08 1.7 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 110.82 -179.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' LYS . . . . . 0.457 ' CD ' ' HA3' ' A' ' 424' ' ' GLY . 0.0 OUTLIER -154.23 167.12 30.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.598 -0.689 . . . . 0.0 109.781 176.606 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . 0.402 ' O ' ' HB ' ' A' ' 421' ' ' ILE . . . -171.81 -84.2 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.025 -1.047 . . . . 0.0 110.602 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 303' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.37 87.57 0.12 Allowed Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.059 -1.026 . . . . 0.0 110.532 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 304' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -53.15 144.65 46.53 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 O-C-N 123.59 1.31 . . . . 0.0 110.772 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 305' ' ' VAL . . . . . 0.459 HG13 ' CZ ' ' A' ' 333' ' ' PHE . 17.7 t -51.65 -28.08 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.274 -0.891 . . . . 0.0 109.83 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 306' ' ' ILE . . . . . 0.976 HG23 HG12 ' A' ' 318' ' ' ILE . 37.5 mm -59.28 -46.23 92.51 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.0 110.012 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -72.25 -45.43 60.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.354 -0.841 . . . . 0.0 110.236 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 308' ' ' PHE . . . . . 0.592 ' O ' HG23 ' A' ' 312' ' ' VAL . 3.0 t80 -52.3 -50.5 62.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.186 -0.946 . . . . 0.0 110.387 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 309' ' ' MET . . . . . 0.453 ' HE2' HD13 ' A' ' 318' ' ' ILE . 39.3 ttp -58.49 -54.38 47.67 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.226 -0.922 . . . . 0.0 110.095 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 310' ' ' CYS . . . . . 0.426 ' HA ' HD12 ' A' ' 315' ' ' ILE . 42.0 t -54.15 -23.06 12.87 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -0.902 . . . . 0.0 110.042 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 311' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -28.73 18.73 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.4 -0.813 . . . . 0.0 110.509 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 312' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 308' ' ' PHE . 87.9 t -85.87 -42.51 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.241 -0.912 . . . . 0.0 110.669 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 313' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 313' ' ' LEU . 83.9 mt -96.61 11.59 34.75 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.275 -0.891 . . . . 0.0 110.953 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 2.9 t0 50.79 93.72 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.001 -1.062 . . . . 0.0 110.427 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 315' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' A' ' 310' ' ' CYS . 86.6 mt -133.52 146.77 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.935 . . . . 0.0 110.674 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 316' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.96 -37.93 54.27 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.31 -0.869 . . . . 0.0 110.288 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 317' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.22 120.85 3.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.279 -0.888 . . . . 0.0 110.263 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 318' ' ' ILE . . . . . 0.976 HG12 HG23 ' A' ' 306' ' ' ILE . 6.9 tp -52.38 -22.75 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.295 -0.878 . . . . 0.0 110.498 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 319' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -84.91 -16.73 40.1 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.18 -0.95 . . . . 0.0 110.572 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 320' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -86.26 -16.34 37.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.113 -0.992 . . . . 0.0 110.699 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 321' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -50.68 -69.83 0.1 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 53.59 21.48 2.57 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.212 -0.93 . . . . 0.0 110.843 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 323' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 324' ' ' PRO . 3.0 mmmm -137.95 148.36 60.16 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.037 -1.039 . . . . 0.0 110.486 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 324' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 323' ' ' LYS . 3.0 Cg_exo -70.62 140.5 39.57 Favored 'Trans proline' 0 C--N 1.313 -1.316 0 O-C-N 123.535 1.281 . . . . 0.0 110.381 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 325' ' ' LEU . . . . . 0.568 HD12 ' CG ' ' A' ' 401' ' ' PRO . 74.3 mt -70.23 140.99 52.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.217 -0.927 . . . . 0.0 110.14 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 326' ' ' THR . . . . . . . . . . . . . 1.8 p -89.83 176.27 6.9 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.166 -0.959 . . . . 0.0 110.475 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 327' ' ' ASP . . . . . 0.694 ' O ' HG23 ' A' ' 331' ' ' VAL . 8.1 m-20 -52.76 -53.86 42.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.879 . . . . 0.0 110.492 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 328' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.86 -53.3 50.87 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.248 -0.908 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -47.53 83.33 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.27 -0.894 . . . . 0.0 110.41 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 24.2 ttm180 -55.76 -52.97 62.11 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 110.441 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 331' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 327' ' ' ASP . 43.0 t -58.47 -33.34 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.388 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 332' ' ' LYS . . . . . 0.476 ' HD2' HG12 ' A' ' 312' ' ' VAL . 0.6 OUTLIER -59.59 -65.64 0.64 Allowed 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.27 -0.894 . . . . 0.0 110.413 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 333' ' ' PHE . . . . . 0.459 ' CZ ' HG13 ' A' ' 305' ' ' VAL . 36.2 t80 -54.75 -44.77 73.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.261 -0.899 . . . . 0.0 110.537 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 334' ' ' THR . . . . . . . . . . . . . 82.5 m -55.06 -43.1 73.52 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.231 -0.918 . . . . 0.0 110.519 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 335' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -39.54 93.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.198 -0.939 . . . . 0.0 110.457 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.23 -51.81 66.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.266 -0.896 . . . . 0.0 110.523 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 337' ' ' ILE . . . . . 0.49 ' HB ' HG11 ' A' ' 356' ' ' VAL . 23.0 pt -69.11 -133.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.247 -0.908 . . . . 0.0 110.281 -179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 338' ' ' LYS . . . . . 0.515 ' H ' HG11 ' A' ' 356' ' ' VAL . 3.3 tptt 62.99 94.02 0.05 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.648 -1.283 . . . . 0.0 110.26 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 339' ' ' GLY . . . . . . . . . . . . . . . 107.04 -36.3 4.49 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 340' ' ' LEU . . . . . . . . . . . . . 8.9 mp -53.96 155.01 3.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.28 -1.129 . . . . 0.0 110.369 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 341' ' ' LYS . . . . . 0.439 ' O ' ' HB ' ' A' ' 422' ' ' VAL . 1.6 tpmt? -99.57 112.75 24.92 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.195 -0.941 . . . . 0.0 109.844 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 342' ' ' ILE . . . . . 0.986 HD11 HG11 ' A' ' 405' ' ' VAL . 1.3 pp -108.0 141.14 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 120.885 -1.134 . . . . 0.0 111.087 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 343' ' ' GLU . . . . . 0.445 ' HA ' ' HA ' ' A' ' 353' ' ' LYS . 9.2 pt-20 -111.41 153.08 26.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.351 -0.843 . . . . 0.0 110.03 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 344' ' ' ILE . . . . . 0.817 HD11 ' HB2' ' A' ' 352' ' ' ARG . 21.3 pt -89.83 123.28 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 120.992 -1.067 . . . . 0.0 110.713 -179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 345' ' ' THR . . . . . 0.511 HG22 ' CG ' ' A' ' 351' ' ' ARG . 77.7 p -141.46 101.34 3.97 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 346' ' ' HIS . . . . . 0.837 ' HB3' HG22 ' A' ' 418' ' ' VAL . 35.8 p-80 -150.44 -40.17 0.13 Allowed 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.353 -0.842 . . . . 0.0 110.672 -177.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 347' ' ' CYS . . . . . 0.485 ' N ' ' CD2' ' A' ' 346' ' ' HIS . 8.6 t -83.18 -27.28 30.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.184 -0.947 . . . . 0.0 110.194 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 348' ' ' GLY . . . . . . . . . . . . . . . 72.45 37.36 58.62 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 349' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -146.93 -43.91 0.18 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.198 -1.178 . . . . 0.0 110.478 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 350' ' ' MET . . . . . . . . . . . . . 12.8 mmt -102.29 -61.32 1.41 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.238 -0.914 . . . . 0.0 110.578 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 351' ' ' ARG . . . . . 0.511 ' CG ' HG22 ' A' ' 345' ' ' THR . 0.0 OUTLIER 60.41 148.8 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.401 -0.812 . . . . 0.0 110.488 -179.58 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 352' ' ' ARG . . . . . 0.817 ' HB2' HD11 ' A' ' 344' ' ' ILE . 0.0 OUTLIER -159.13 -168.47 2.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.131 -0.981 . . . . 0.0 110.407 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 353' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 343' ' ' GLU . 0.1 OUTLIER -138.39 138.35 38.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.118 -0.989 . . . . 0.0 111.27 -179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 354' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -150.51 168.27 24.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.524 -0.735 . . . . 0.0 109.9 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 355' ' ' ARG . . . . . . . . . . . . . 39.0 ttp85 -103.59 158.75 16.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.918 -1.113 . . . . 0.0 110.151 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 356' ' ' VAL . . . . . 0.735 ' HA ' HG12 ' A' ' 405' ' ' VAL . 60.5 t -77.48 160.77 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 110.338 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 357' ' ' CYS . . . . . 0.401 ' N ' HG12 ' A' ' 356' ' ' VAL . 0.8 OUTLIER -144.61 -38.72 0.28 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.246 -0.909 . . . . 0.0 110.706 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.62 -172.75 0.68 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.947 -1.096 . . . . 0.0 110.807 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 359' ' ' VAL . . . . . . . . . . . . . 88.4 t -131.23 136.45 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.304 -0.872 . . . . 0.0 109.688 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.57 HG21 ' HD2' ' A' ' 413' ' ' TYR . 47.0 p -89.6 145.6 25.14 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.196 -0.94 . . . . 0.0 110.108 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 361' ' ' ARG . . . . . . . . . . . . . 18.7 mtm-85 -88.23 -32.36 18.59 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.417 -0.802 . . . . 0.0 109.651 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 362' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 152.43 24.57 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.242 -0.911 . . . . 0.0 109.193 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 363' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -78.38 151.13 25.85 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 123.58 1.305 . . . . 0.0 110.064 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . 0.752 ' HB3' ' HA ' ' A' ' 398' ' ' PRO . . . -53.97 -44.48 70.82 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.027 -1.045 . . . . 0.0 110.193 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 365' ' ' GLN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 398' ' ' PRO . 3.7 pt20 -43.66 -26.33 0.23 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.585 -0.697 . . . . 0.0 111.139 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 366' ' ' MET . . . . . 0.423 ' HG3' ' HG3' ' A' ' 365' ' ' GLN . 1.0 OUTLIER -128.81 52.67 1.92 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.413 -0.805 . . . . 0.0 110.05 -179.875 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 367' ' ' GLN . . . . . 0.487 ' CB ' ' HB ' ' A' ' 383' ' ' VAL . 4.8 mm-40 -102.76 81.08 1.97 Allowed 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 118.427 -1.309 . . . . 0.0 111.469 -177.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 382' ' ' THR . 12.6 p -64.67 125.86 26.07 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.276 -0.89 . . . . 0.0 110.646 179.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' PHE . . . . . 0.765 ' CD1' HG23 ' A' ' 383' ' ' VAL . 14.8 p90 -135.37 174.87 4.08 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.215 -0.928 . . . . 0.0 110.484 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' PRO . . . . . 0.414 ' HD2' ' HB2' ' A' ' 369' ' ' PHE . 27.9 Cg_endo -89.84 97.64 0.3 Allowed 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.881 1.464 . . . . 0.0 111.152 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 51.3 tp -89.84 116.28 27.8 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.197 -0.94 . . . . 0.0 109.159 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' GLN . . . . . 0.552 ' C ' HD22 ' A' ' 373' ' ' LEU . 0.0 OUTLIER -88.06 133.73 33.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.943 -1.098 . . . . 0.0 110.251 -178.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' LEU . . . . . 0.581 HD23 ' HB ' ' A' ' 379' ' ' VAL . 4.5 mm? -105.34 122.58 46.25 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.515 -0.741 . . . . 0.0 110.596 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -60.47 -15.43 26.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.447 -0.783 . . . . 0.0 110.988 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -52.38 -23.03 5.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.061 -1.024 . . . . 0.0 110.384 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' GLY . . . . . . . . . . . . . . . 124.06 36.77 0.6 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.27 151.26 0.99 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.212 -1.17 . . . . 0.0 110.16 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' THR . . . . . . . . . . . . . 35.8 m -95.24 149.32 21.46 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.073 -1.017 . . . . 0.0 110.173 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' VAL . . . . . 0.581 ' HB ' HD23 ' A' ' 373' ' ' LEU . 48.9 t -126.5 169.65 17.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.566 -0.709 . . . . 0.0 110.555 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.484 ' N ' HG12 ' A' ' 379' ' ' VAL . 17.7 tt0 -123.34 103.67 8.64 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.42 -0.8 . . . . 0.0 109.459 178.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -108.72 -171.78 1.92 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.195 -0.941 . . . . 0.0 110.377 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 368' ' ' SER . 0.2 OUTLIER -126.87 141.23 51.87 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.187 -0.946 . . . . 0.0 110.522 -179.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' VAL . . . . . 0.765 HG23 ' CD1' ' A' ' 369' ' ' PHE . 90.8 t -88.89 152.83 3.29 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.301 -0.875 . . . . 0.0 109.332 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' A' ' 383' ' ' VAL . . . 73.92 25.55 1.89 Allowed 'General case' 0 N--CA 1.501 2.093 0 CA-C-O 121.711 0.767 . . . . 0.0 109.323 -176.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.98 -44.16 0.07 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -68.97 -48.33 63.41 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.538 -0.726 . . . . 0.0 109.201 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 392' ' ' ARG . 89.3 m-85 -53.24 -32.94 50.81 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.496 -0.752 . . . . 0.0 110.1 178.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' LEU . . . . . 0.521 HD11 ' HE2' ' A' ' 394' ' ' LYS . 0.9 OUTLIER -67.01 -25.69 66.42 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.476 -0.765 . . . . 0.0 110.642 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.14 -49.66 6.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.2 -0.938 . . . . 0.0 110.967 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -50.55 6.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.151 -0.968 . . . . 0.0 111.011 -178.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -88.41 -0.34 57.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.136 -0.977 . . . . 0.0 111.125 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 387' ' ' PHE . 16.8 mtt-85 51.76 23.19 1.92 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.955 -1.091 . . . . 0.0 110.55 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 6.2 mmm -84.45 118.69 24.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 109.993 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' LYS . . . . . 0.521 ' HE2' HD11 ' A' ' 388' ' ' LEU . 0.0 OUTLIER -84.48 9.1 14.3 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.061 -1.024 . . . . 0.0 111.134 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 395' ' ' LEU . 0.2 OUTLIER 62.41 -65.97 0.08 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.456 -0.777 . . . . 0.0 112.466 177.47 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 394' ' ' LYS . 0.0 OUTLIER 68.8 7.48 6.18 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.029 -1.044 . . . . 0.0 110.593 -177.467 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' TYR . . . . . 0.545 ' N ' ' CD ' ' A' ' 398' ' ' PRO . 75.4 m-85 -144.77 45.74 0.54 Allowed Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 120.964 -1.085 . . . . 0.0 111.194 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.752 ' HA ' ' HB3' ' A' ' 364' ' ' ALA . 37.0 Cg_endo -74.91 -55.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.282 1.148 . . . . 0.0 111.773 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' HIS . . . . . 0.467 ' HD2' HD12 ' A' ' 400' ' ' LEU . 35.5 p-80 -43.67 -35.22 1.71 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.472 -0.768 . . . . 0.0 111.908 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . 0.467 HD12 ' HD2' ' A' ' 399' ' ' HIS . 0.3 OUTLIER -71.0 177.34 1.54 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 120.941 -1.099 . . . . 0.0 110.325 179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' PRO . . . . . 0.568 ' CG ' HD12 ' A' ' 325' ' ' LEU . 30.6 Cg_endo -80.45 -162.67 0.19 Allowed 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.643 1.338 . . . . 0.0 110.574 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' CYS . . . . . 0.431 ' CB ' ' OG1' ' A' ' 360' ' ' THR . 0.1 OUTLIER -136.97 167.71 20.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.434 179.488 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.6 150.66 22.86 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.303 -0.873 . . . . 0.0 110.624 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.63 122.93 43.74 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.356 -0.84 . . . . 0.0 110.283 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.986 HG11 HD11 ' A' ' 342' ' ' ILE . 16.1 m -138.05 135.09 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.197 -0.939 . . . . 0.0 110.876 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' GLY . . . . . . . . . . . . . . . -150.28 124.45 1.75 Allowed Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.116 -1.594 . . . . 0.0 109.116 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -53.05 -68.25 0.19 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.201 -1.176 . . . . 0.0 110.497 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 -40.56 1.96 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -148.98 35.61 0.76 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.463 -0.773 . . . . 0.0 109.7 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' LYS . . . . . . . . . . . . . 33.5 mttm -93.58 -176.65 4.15 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.458 -0.776 . . . . 0.0 110.785 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.75 57.7 0.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.451 -0.781 . . . . 0.0 109.775 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' THR . . . . . 0.912 HG22 HD21 ' A' ' 414' ' ' LEU . 7.0 m -85.72 114.37 22.63 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.277 -0.89 . . . . 0.0 110.745 -178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' TYR . . . . . 0.57 ' HD2' HG21 ' A' ' 360' ' ' THR . 84.5 m-85 -97.75 108.97 21.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.326 -0.859 . . . . 0.0 109.965 179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' LEU . . . . . 0.912 HD21 HG22 ' A' ' 412' ' ' THR . 3.3 mm? -104.82 159.55 28.97 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.13 -0.981 . . . . 0.0 110.162 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' PRO . . . . . 0.426 ' HB3' HD11 ' A' ' 395' ' ' LEU . 10.5 Cg_endo -88.58 -160.27 0.1 OUTLIER 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.613 1.323 . . . . 0.0 110.041 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' LEU . . . . . 0.589 HD22 ' N ' ' A' ' 416' ' ' LEU . 4.1 mm? -61.66 -67.63 0.39 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.074 -1.016 . . . . 0.0 109.197 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' GLU . . . . . 0.501 ' C ' HG23 ' A' ' 418' ' ' VAL . 3.1 tt0 -59.43 -165.38 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.157 -0.964 . . . . 0.0 108.676 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' VAL . . . . . 0.837 HG22 ' HB3' ' A' ' 346' ' ' HIS . 2.4 t 66.04 -69.41 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 120.879 -1.138 . . . . 0.0 109.593 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' CYS . . . . . 0.873 ' SG ' HD13 ' A' ' 342' ' ' ILE . 48.0 t -71.56 91.2 1.05 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.677 -1.264 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 342' ' ' ILE . 0.8 OUTLIER -89.33 165.04 14.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -0.902 . . . . 0.0 109.284 178.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' ILE . . . . . 0.621 HD13 HG22 ' A' ' 342' ' ' ILE . 36.0 mm -100.0 151.14 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.165 -0.959 . . . . 0.0 111.178 -178.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' VAL . . . . . 0.527 HG12 ' HG3' ' A' ' 426' ' ' ARG . 2.4 t -148.56 126.96 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.328 -0.857 . . . . 0.0 109.442 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.422 ' HB2' ' O ' ' A' ' 422' ' ' VAL . . . -177.61 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.357 -0.839 . . . . 0.0 109.855 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . 0.457 ' HA3' ' CD ' ' A' ' 301' ' ' LYS . . . -110.84 -113.92 3.47 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' GLN . . . . . 0.464 ' CB ' ' HB3' ' A' ' 300' ' ' TYR . 2.1 tt0 -102.21 72.87 1.32 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.104 -1.233 . . . . 0.0 109.929 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . 0.527 ' HG3' HG12 ' A' ' 422' ' ' VAL . 2.4 mmt180 -94.09 146.24 24.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.415 -0.803 . . . . 0.0 110.89 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -149.57 93.21 2.02 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.956 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' ILE . . . . . . . . . . . . . 42.6 pt -113.99 -166.74 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.158 -0.964 . . . . 0.0 110.732 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -105.2 111.79 24.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.3 -0.875 . . . . 0.0 110.341 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -94.22 22.01 6.37 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 110.411 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -159.29 -172.12 3.62 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.421 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' THR . . . . . . . . . . . . . 9.6 t -167.95 -160.35 0.33 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 110.406 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.0 142.34 50.64 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.274 -0.891 . . . . 0.0 110.364 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.66 62.01 1.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 110.352 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -118.23 118.28 31.41 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.23 -0.919 . . . . 0.0 110.457 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' THR . . . . . . . . . . . . . 87.7 m -97.71 137.13 37.06 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.297 -0.877 . . . . 0.0 110.291 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' SER . . . . . . . . . . . . . 1.2 m -111.08 -174.39 2.46 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.22 -0.925 . . . . 0.0 110.414 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 43.94 32.43 0.62 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.495 -0.753 . . . . 0.0 111.004 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.04 78.05 2.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' ILE . . . . . 0.546 ' O ' HG23 ' A' ' 440' ' ' ILE . 10.8 tt -95.74 69.87 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.279 -0.888 . . . . 0.0 110.158 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.14 -172.0 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.469 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -102.85 154.2 19.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.224 -0.923 . . . . 0.0 110.283 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.59 157.08 37.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.93 . . . . 0.0 110.405 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' ALA . . . . . . . . . . . . . . . -83.89 62.77 7.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.248 -0.907 . . . . 0.0 110.329 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.6 176.33 10.49 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.247 -0.908 . . . . 0.0 110.359 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.73 -177.09 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.25 -0.906 . . . . 0.0 110.435 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -157.28 154.63 26.23 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.397 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -54.67 152.89 25.99 Favored 'Trans proline' 0 C--N 1.312 -1.364 0 O-C-N 123.613 1.323 . . . . 0.0 110.475 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 450' ' ' ARG . 17.6 t0 -107.8 174.37 5.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 110.343 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 449' ' ' ASP . 0.0 OUTLIER -55.46 143.84 27.79 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.317 -0.864 . . . . 0.0 110.329 179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -128.77 170.05 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.178 -0.952 . . . . 0.0 110.262 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 454' ' ' ILE . 0.1 OUTLIER -59.61 99.45 0.06 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 110.294 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.09 70.96 0.16 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.229 -0.919 . . . . 0.0 110.491 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.413 ' N ' ' O ' ' A' ' 452' ' ' ARG . 43.0 mt -57.88 133.37 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.177 -0.952 . . . . 0.0 110.25 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -93.59 155.08 17.5 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 110.44 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 53.22 176.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.365 -0.834 . . . . 0.0 110.449 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 3.8 mt 52.98 177.42 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.465 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 458' ' ' VAL . 10.4 p -161.21 34.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.201 -0.937 . . . . 0.0 110.285 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm 55.2 171.68 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.301 -0.874 . . . . 0.0 110.481 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . . . . . . . . . 29.6 ttm-85 -131.11 118.49 20.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.206 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' ALA . . . . . . . . . . . . . . . -96.75 175.81 6.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 110.47 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.95 174.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 110.482 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -104.99 -60.29 1.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.237 -0.914 . . . . 0.0 110.263 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.333 -179.895 . . . . . . . . 0 0 . 1 stop_ save_